REAL300024787275.mol2 37                                                        
   1       C     0.07     0.33    10.24      59.85       0.61     0.95     16
   2       N    -0.61    -4.28     2.87    -181.57      -0.52    -4.80     16
   3       C     0.11     0.37     5.52      -4.04      -0.02     0.35     16
   4       C     0.10     0.41     6.00      -4.04      -0.02     0.39     16
   5       N    -0.71    -0.22     5.56     -60.29      -0.33    -0.55     16
   6       C     0.46     1.44     7.15     -10.98      -0.08     1.37     16
   7       O    -0.44    -4.30    12.46       5.56       0.07    -4.23     16
   8       C     0.38     0.00     5.47      36.01       0.20     0.20     16
   9       F    -0.13    -2.05    16.66       2.25       0.04    -2.01     16
  10       F    -0.12    -1.50    13.71       2.25       0.03    -1.47     16
  11       F    -0.21    -2.20    15.87       2.25       0.04    -2.17     16
  12       F    -0.11    -1.45    13.71       2.25       0.03    -1.42     16
  13       F    -0.21    -2.22    15.87       2.25       0.04    -2.18     16
  14       C     0.54     6.34     7.69     -10.99      -0.08     6.26     16
  15       O    -0.51    -7.63    15.44       5.55       0.09    -7.55     16
  16       C    -0.15    -2.12     4.22      36.01       0.15    -1.97     16
  17       S     0.06     1.13    21.45    -107.50      -2.31    -1.17     16
  18       C     0.20     5.22     8.33     -88.19      -0.73     4.48     16
  19       N    -0.40    -9.94    11.98      30.72       0.37    -9.57     16
  20       N    -0.58   -15.60     7.39      27.70       0.20   -15.40     16
  21       C     0.58    18.27     9.41     -86.79      -0.82    17.45     16
  22       O    -0.65   -22.07    18.06       5.08       0.09   -21.97     16
  23       N    -0.65   -20.05    11.63     -16.33      -0.19   -20.24     16
  24       H     0.06     0.25     8.14     -51.93      -0.42    -0.18     16
  25       H     0.08     0.47     6.44     -51.93      -0.33     0.14     16
  26       H     0.07     0.17     8.07     -51.93      -0.42    -0.25     16
  27       H     0.10     0.41     7.42     -51.93      -0.39     0.03     16
  28       H     0.09     0.01     8.07     -51.93      -0.42    -0.41     16
  29       H     0.08     0.36     8.14     -51.93      -0.42    -0.07     16
  30       H     0.09     0.67     8.14     -51.93      -0.42     0.24     16
  31       H     0.41    -1.81     8.47     -40.82      -0.35    -2.16     16
  32       H     0.19    -0.94     7.65     -51.93      -0.40    -1.34     16
  33       H     0.19    -1.05     7.65     -51.92      -0.40    -1.44     16
  34       H     0.12     1.58     7.40     -51.92      -0.38     1.20     16
  35       H     0.12     1.56     8.11     -51.92      -0.42     1.14     16
  36       H     0.40     9.30     8.96    -182.55      -1.64     7.67     16
 Total:         -1.00   -51.14   349.38                 -4.30   -55.44