REAL300018525197.mol2 37                                                        
   1       C     0.01     0.14    11.13     113.37       1.26     1.40     16
   2       O    -0.33    -7.90     9.50     -91.69      -0.87    -8.77     16
   3       C     0.09     2.38     5.75      22.76       0.13     2.51     16
   4       C     0.10     2.82     7.29      22.38       0.16     2.98     16
   5       F    -0.11    -3.02    17.10      44.97       0.77    -2.25     16
   6       C    -0.03    -1.21     9.56      22.60       0.22    -1.00     16
   7       C    -0.11    -4.66     5.87     -20.11      -0.12    -4.78     16
   8       C     0.51    29.41     8.00      70.19       0.56    29.97     16
   9       O    -0.71   -45.01    17.23      17.64       0.30   -44.71     16
  10       O    -0.70   -44.30    17.23      17.67       0.30   -44.00     16
  11       C    -0.07    -2.36     8.85      22.68       0.20    -2.16     16
  12       C     0.20     5.56     6.66      38.16       0.25     5.81     16
  13       N    -0.49   -11.09     5.72    -342.86      -1.96   -13.05     16
  14       C     0.11     2.19     4.72      85.63       0.40     2.59     16
  15       C    -0.14    -2.45     5.25     -19.65      -0.10    -2.56     16
  16       C    -0.03    -0.10     9.66      22.24       0.21     0.11     16
  17       C    -0.10     0.05    10.04      22.33       0.22     0.27     16
  18       C    -0.04    -0.23    10.03      22.24       0.22     0.00     16
  19       C    -0.15    -3.04     9.87      22.48       0.22    -2.82     16
  20       C     0.25     7.53     8.94      22.82       0.20     7.73     16
  21       O    -0.90   -60.84    16.78    -127.47      -2.14   -62.98     16
  22       O    -0.95   -66.58    17.89    -127.47      -2.28   -68.86     16
  23       H     0.13     0.99     8.14      -2.39      -0.02     0.97     16
  24       H     0.08     0.50     8.14      -2.39      -0.02     0.48     16
  25       H     0.07     0.72     8.14      -2.39      -0.02     0.70     16
  26       H     0.17     5.84     7.63      -2.91      -0.02     5.82     16
  27       H     0.17     5.57     6.30      -2.91      -0.02     5.56     16
  28       H     0.43     8.92     7.82     -92.71      -0.72     8.20     16
  29       H     0.11     3.60     4.74      -2.39      -0.01     3.59     16
  30       H     0.19     1.52     7.74      -2.39      -0.02     1.50     16
  31       H     0.21    -1.42     8.00      -2.91      -0.02    -1.44     16
  32       H     0.21    -2.03     8.06      -2.91      -0.02    -2.05     16
  33       H     0.20    -0.51     8.06      -2.91      -0.02    -0.54     16
  34       H     0.14     3.49     8.06      -2.91      -0.02     3.47     16
  35       H     0.25    14.37     6.78     -74.05      -0.50    13.87     16
  36       H     0.25    14.67     8.83     -74.06      -0.65    14.01     16
 Total:         -1.00  -146.51   329.53                 -3.92  -150.43