REAL300009850705.mol2 38                                                        
   1       C    -0.12    -4.29     9.09      71.98       0.65    -3.64     16
   2       C    -0.10    -3.72     5.92     -10.79      -0.06    -3.78     16
   3       H     0.13     4.31     7.67      -2.39      -0.02     4.29     16
   4       C    -0.11    -3.94     9.39      30.59       0.29    -3.65     16
   5       C    -0.26   -11.47     2.55     -53.67      -0.14   -11.61     16
   6       C     0.52    29.73     6.40      71.23       0.46    30.19     16
   7       O    -0.72   -44.86    16.73      19.04       0.32   -44.54     16
   8       O    -0.71   -44.16    16.06      19.06       0.31   -43.85     16
   9       C     0.58    23.28     6.86      87.66       0.60    23.88     16
  10       O    -0.55   -22.19    13.93      -3.03      -0.04   -22.23     16
  11       N    -0.66   -22.64     4.84    -303.58      -1.47   -24.11     16
  12       C     0.17     4.63     6.26      38.23       0.24     4.87     16
  13       C    -0.13    -2.29     9.69      22.67       0.22    -2.07     16
  14       C    -0.03    -0.41     5.74     -21.25      -0.12    -0.53     16
  15       C    -0.02    -0.13     9.73      22.31       0.22     0.09     16
  16       C    -0.11    -1.54     9.65      22.23       0.21    -1.33     16
  17       C     0.32     6.96     9.78      22.86       0.22     7.18     16
  18       O    -0.75   -28.29    17.19    -127.47      -2.19   -30.48     16
  19       O    -0.73   -26.35    17.20    -127.47      -2.19   -28.55     16
  20       C    -0.07    -1.28     9.49      22.79       0.22    -1.06     16
  21       C    -0.04    -0.66     5.74     -21.28      -0.12    -0.78     16
  22       C    -0.06    -1.24     9.74      22.33       0.22    -1.02     16
  23       C    -0.12    -3.11     8.54      22.16       0.19    -2.92     16
  24       H     0.03     1.37     8.14      -2.38      -0.02     1.35     16
  25       H     0.10     2.68     8.14      -2.39      -0.02     2.66     16
  26       H     0.05     2.15     7.07      -2.38      -0.02     2.13     16
  27       H     0.12     3.52     8.14      -2.38      -0.02     3.50     16
  28       H     0.10     3.93     7.60      -2.39      -0.02     3.92     16
  29       H     0.42    14.77     7.84     -92.71      -0.73    14.04     16
  30       H     0.18     2.02     8.06      -2.91      -0.02     2.00     16
  31       H     0.22    -0.10     8.06      -2.91      -0.02    -0.13     16
  32       H     0.19     2.32     7.73      -2.91      -0.02     2.29     16
  33       H     0.33    10.92     8.90     -74.05      -0.66    10.26     16
  34       H     0.33    10.52     8.90     -74.06      -0.66     9.86     16
  35       H     0.18     3.33     7.73      -2.91      -0.02     3.30     16
  36       H     0.17     2.40     8.06      -2.91      -0.02     2.38     16
  37       H     0.13     4.04     6.39      -2.91      -0.02     4.02     16
 Total:         -1.00   -89.78   328.98                 -4.27   -94.05