REAL300018579103.mol2 44                                                        
   1       O    -0.68   -17.62    17.25     -20.54      -0.35   -17.97     16
   2       C     0.51    11.65     8.01      34.52       0.28    11.92     16
   3       O    -0.68   -17.58    17.25     -20.53      -0.35   -17.93     16
   4       C    -0.11    -1.54     5.87    -105.00      -0.62    -2.16     16
   5       C    -0.08    -0.75     9.60     -39.15      -0.38    -1.13     16
   6       C    -0.12    -0.27     9.46     -39.65      -0.37    -0.64     16
   7       C    -0.10     0.15     5.13    -104.51      -0.54    -0.39     16
   8       C    -0.12     1.05     1.86    -155.66      -0.29     0.76     16
   9       C     0.04    -0.58     5.29      -3.82      -0.02    -0.60     16
  10       N    -0.50     7.91     1.60    -115.06      -0.18     7.72     16
  11       H     0.44    -5.54     7.09     -39.29      -0.28    -5.81     16
  12       H     0.41    -7.97     8.07     -39.29      -0.32    -8.28     16
  13       C     0.05    -0.74     4.63      -4.98      -0.02    -0.77     16
  14       C    -0.14     2.00     5.38    -104.29      -0.56     1.44     16
  15       C    -0.06     0.98     9.66     -39.63      -0.38     0.60     16
  16       C    -0.11     1.57    10.04     -39.48      -0.40     1.17     16
  17       C    -0.04     0.57    10.03     -39.63      -0.40     0.18     16
  18       C    -0.11     1.10     9.75     -39.25      -0.38     0.72     16
  19       C     0.31    -2.90     9.76     -38.73      -0.38    -3.28     16
  20       O    -0.57    -0.12    17.25     -57.73      -1.00    -1.12     16
  21       O    -0.72     3.46    12.35     -57.73      -0.71     2.74     16
  22       C    -0.13     1.02     9.88     -26.73      -0.26     0.75     16
  23       C    -0.17     1.66     8.96     -26.73      -0.24     1.42     16
  24       C    -0.13    -0.21     9.20     -39.65      -0.36    -0.57     16
  25       C    -0.08    -0.74     9.60     -39.15      -0.38    -1.11     16
  26       H     0.13     1.44     7.65     -52.49      -0.40     1.04     16
  27       H     0.11    -0.09     8.06     -52.48      -0.42    -0.51     16
  28       H     0.13    -2.19     7.90     -51.93      -0.41    -2.60     16
  29       H     0.14    -1.66     7.91     -51.93      -0.41    -2.07     16
  30       H     0.14    -2.77     7.97     -51.93      -0.41    -3.19     16
  31       H     0.17    -2.21     5.77     -51.93      -0.30    -2.51     16
  32       H     0.17    -3.32     8.04     -52.48      -0.42    -3.74     16
  33       H     0.17    -2.69     8.06     -52.49      -0.42    -3.11     16
  34       H     0.17    -2.51     8.06     -52.49      -0.42    -2.93     16
  35       H     0.18    -1.58     7.77     -52.48      -0.41    -1.99     16
  36       H     0.36    -0.34     8.90      45.56       0.41     0.07     16
  37       H     0.35    -1.05     8.90      45.56       0.41    -0.64     16
  38       H     0.11    -1.06     8.10     -51.93      -0.42    -1.48     16
  39       H     0.11    -0.52     8.14     -51.93      -0.42    -0.95     16
  40       H     0.11    -0.81     7.16     -51.93      -0.37    -1.18     16
  41       H     0.10    -1.34     8.05     -51.93      -0.42    -1.76     16
  42       H     0.11    -0.26     7.03     -52.48      -0.37    -0.63     16
  43       H     0.13     1.37     7.65     -52.49      -0.40     0.97     16
 Total:          0.00   -45.04   364.10                 -9.04   -54.08