REAL300018286298.mol2 37                                                        
   1       O    -0.70   -16.37    18.00      19.06       0.34   -16.03     16
   2       C     0.48     4.07     6.09      71.23       0.43     4.51     16
   3       O    -0.69    -9.00    16.46      19.04       0.31    -8.69     16
   4       C     0.04    -0.50     2.29      43.42       0.10    -0.40     16
   5       N    -0.47    13.91     1.06    -503.39      -0.53    13.38     16
   6       H     0.45   -18.46     8.44     -89.69      -0.76   -19.22     16
   7       H     0.44   -12.63     6.42     -89.70      -0.58   -13.21     16
   8       C     0.05    -1.51     5.21      85.56       0.45    -1.07     16
   9       C    -0.10     3.09     5.36     -19.80      -0.11     2.98     16
  10       C    -0.01     0.17     9.68      22.24       0.22     0.38     16
  11       C    -0.11     1.88     9.75      22.48       0.22     2.10     16
  12       C     0.33    -2.17     9.80      22.82       0.22    -1.94     16
  13       O    -0.74   -11.96    17.25    -127.47      -2.20   -14.16     16
  14       O    -0.75   -13.69    17.25    -127.47      -2.20   -15.89     16
  15       C    -0.12     1.46     9.75      22.48       0.22     1.68     16
  16       C    -0.02     0.56     9.68      22.24       0.22     0.77     16
  17       C    -0.12     1.11     4.95     -19.83      -0.10     1.02     16
  18       C    -0.12     1.61     9.13      22.31       0.20     1.82     16
  19       C     0.09    -0.72     7.30      22.37       0.16    -0.56     16
  20       F    -0.14     0.68    17.27      44.97       0.78     1.45     16
  21       C    -0.11     0.93    10.02      22.31       0.22     1.15     16
  22       C    -0.12     0.79    10.02      22.31       0.22     1.01     16
  23       C     0.10    -0.37     7.24      22.37       0.16    -0.21     16
  24       F    -0.13    -0.29    16.57      44.97       0.74     0.46     16
  25       H     0.18    -3.04     7.73      -2.39      -0.02    -3.05     16
  26       H     0.13    -2.84     6.67      -2.39      -0.02    -2.85     16
  27       H     0.19    -7.24     8.05      -2.39      -0.02    -7.25     16
  28       H     0.24    -9.69     8.06      -2.91      -0.02    -9.71     16
  29       H     0.18    -2.77     7.77      -2.91      -0.02    -2.79     16
  30       H     0.34     4.65     8.90     -74.06      -0.66     3.99     16
  31       H     0.33     5.15     8.90     -74.05      -0.66     4.49     16
  32       H     0.17    -1.37     7.77      -2.91      -0.02    -1.39     16
  33       H     0.20    -4.84     8.06      -2.90      -0.02    -4.87     16
  34       H     0.18    -3.93     6.40      -2.91      -0.02    -3.95     16
  35       H     0.17    -1.92     8.06      -2.91      -0.02    -1.94     16
  36       H     0.17    -1.55     8.06      -2.91      -0.02    -1.58     16
 Total:          0.00   -86.82   329.46                 -2.77   -89.59