REAL300018491457.mol2 44                                                        
   1       O    -0.68   -16.11    17.40     -26.63      -0.46   -16.58     16
   2       C     0.50    10.70     8.13      36.01       0.29    10.99     16
   3       O    -0.69   -17.74    18.00     -20.23      -0.36   -18.10     16
   4       C     0.00    -0.05     6.31      36.01       0.23     0.18     16
   5       O    -0.35    -2.55     8.17     -55.08      -0.45    -3.00     16
   6       C     0.07     0.02     2.92     -26.73      -0.08    -0.06     16
   7       C    -0.11     0.36     5.66     -26.73      -0.15     0.21     16
   8       C    -0.14     0.98     5.27     -26.73      -0.14     0.84     16
   9       C     0.04    -0.41     2.28     -67.72      -0.15    -0.57     16
  10       N    -0.50     7.40     1.42    -108.00      -0.15     7.25     16
  11       H     0.42    -7.00     8.59     -39.29      -0.34    -7.34     16
  12       H     0.43    -6.34     6.95     -39.29      -0.27    -6.61     16
  13       C     0.04    -0.64     4.36      -4.98      -0.02    -0.66     16
  14       C    -0.14     1.87     5.38    -104.29      -0.56     1.31     16
  15       C    -0.06     0.82     9.66     -39.63      -0.38     0.44     16
  16       C    -0.10     1.43    10.04     -39.48      -0.40     1.03     16
  17       C    -0.04     0.58    10.03     -39.63      -0.40     0.18     16
  18       C    -0.11     1.22     9.75     -39.25      -0.38     0.83     16
  19       C     0.32    -3.32     9.76     -38.72      -0.38    -3.70     16
  20       O    -0.74     5.40    12.34     -57.73      -0.71     4.69     16
  21       O    -0.59     1.55    17.25     -57.73      -1.00     0.55     16
  22       C    -0.14     1.10     4.84     -26.73      -0.13     0.97     16
  23       C    -0.13     0.49     5.63     -26.73      -0.15     0.34     16
  24       H     0.04     0.46     7.87     -51.93      -0.41     0.06     16
  25       H     0.05     0.56     8.08     -51.93      -0.42     0.14     16
  26       H     0.07     0.08     7.79     -51.93      -0.40    -0.32     16
  27       H     0.08    -0.45     8.14     -51.93      -0.42    -0.87     16
  28       H     0.09    -0.12     8.14     -51.93      -0.42    -0.54     16
  29       H     0.10    -0.46     7.68     -51.93      -0.40    -0.85     16
  30       H     0.08    -0.73     8.14     -51.93      -0.42    -1.15     16
  31       H     0.13    -1.61     8.09     -51.93      -0.42    -2.03     16
  32       H     0.17    -2.12     5.76     -51.93      -0.30    -2.42     16
  33       H     0.14    -2.38     6.15     -51.93      -0.32    -2.70     16
  34       H     0.18    -3.01     8.04     -52.48      -0.42    -3.43     16
  35       H     0.17    -2.60     8.06     -52.49      -0.42    -3.02     16
  36       H     0.18    -2.63     8.06     -52.49      -0.42    -3.05     16
  37       H     0.18    -1.87     7.77     -52.49      -0.41    -2.28     16
  38       H     0.34    -2.41     8.90      45.56       0.41    -2.01     16
  39       H     0.35    -1.66     8.90      45.56       0.41    -1.26     16
  40       H     0.08    -0.86     6.41     -51.93      -0.33    -1.19     16
  41       H     0.10    -0.54     7.68     -51.93      -0.40    -0.94     16
  42       H     0.07    -0.44     8.14     -51.93      -0.42    -0.86     16
  43       H     0.08    -0.12     7.87     -51.93      -0.41    -0.53     16
 Total:          0.00   -43.11   345.81                 -7.71   -50.82