REAL300009850674.mol2 38                                                        
   1       O    -0.73   -51.63    17.23      17.90       0.31   -51.32     16
   2       C     0.50    32.15     8.01      70.34       0.56    32.71     16
   3       O    -0.72   -50.07    17.23      17.93       0.31   -49.76     16
   4       C    -0.14    -6.98     5.88     -20.06      -0.12    -7.10     16
   5       C    -0.10    -4.20     9.58      22.52       0.22    -3.98     16
   6       C    -0.07    -2.03     9.58      22.49       0.22    -1.82     16
   7       C    -0.14    -3.42     5.88     -20.04      -0.12    -3.54     16
   8       C     0.58    11.29     7.61      86.85       0.66    11.95     16
   9       O    -0.54   -13.51    13.73      -3.81      -0.05   -13.56     16
  10       N    -0.65    -6.60     5.25    -306.00      -1.61    -8.21     16
  11       C     0.17     1.54     6.28      38.27       0.24     1.78     16
  12       C    -0.11    -0.30     9.69      22.68       0.22    -0.08     16
  13       C    -0.03    -0.14     5.74     -21.26      -0.12    -0.26     16
  14       C    -0.01     0.00     9.73      22.31       0.22     0.21     16
  15       C    -0.12    -0.96     9.65      22.23       0.21    -0.75     16
  16       C     0.32     5.32     9.78      22.86       0.22     5.54     16
  17       O    -0.74   -24.26    17.20    -127.47      -2.19   -26.45     16
  18       O    -0.75   -26.06    17.19    -127.47      -2.19   -28.25     16
  19       C    -0.08    -0.94     9.49      22.79       0.22    -0.73     16
  20       C    -0.03    -0.29     5.74     -21.28      -0.12    -0.42     16
  21       C    -0.07    -0.67     9.74      22.33       0.22    -0.46     16
  22       C    -0.11    -1.33     8.59      22.16       0.19    -1.14     16
  23       C    -0.07    -1.56     9.52      22.49       0.21    -1.35     16
  24       C    -0.10    -3.47     9.58      22.51       0.22    -3.25     16
  25       H     0.12     5.17     7.63      -2.91      -0.02     5.14     16
  26       H     0.15     4.10     7.64      -2.91      -0.02     4.08     16
  27       H     0.43     1.37     6.85     -92.71      -0.63     0.74     16
  28       H     0.19    -0.97     8.06      -2.91      -0.02    -0.99     16
  29       H     0.23    -2.04     8.06      -2.91      -0.02    -2.07     16
  30       H     0.18     1.42     7.73      -2.91      -0.02     1.40     16
  31       H     0.33     9.65     8.90     -74.06      -0.66     8.99     16
  32       H     0.33    10.03     8.90     -74.06      -0.66     9.37     16
  33       H     0.18     2.35     7.73      -2.91      -0.02     2.33     16
  34       H     0.16     0.96     8.06      -2.91      -0.02     0.94     16
  35       H     0.14     2.24     6.19      -2.91      -0.02     2.22     16
  36       H     0.18     1.80     6.40      -2.91      -0.02     1.78     16
  37       H     0.13     4.86     7.63      -2.91      -0.02     4.84     16
 Total:         -1.00  -107.22   337.70                 -4.25  -111.47