REAL300009850841.mol2 42                                                        
   1       O    -0.68   -24.12    17.23     -20.51      -0.35   -24.47     16
   2       C     0.52    16.94     8.01      34.63       0.28    17.22     16
   3       O    -0.68   -23.86    17.23     -20.51      -0.35   -24.21     16
   4       C    -0.10    -2.69     5.88    -104.93      -0.62    -3.31     16
   5       C    -0.10    -2.22     9.58     -39.20      -0.38    -2.60     16
   6       C    -0.08    -1.50     9.58     -39.25      -0.38    -1.88     16
   7       C    -0.15    -2.74     5.88    -104.88      -0.62    -3.36     16
   8       C     0.58     9.54     7.81     -12.22      -0.10     9.44     16
   9       O    -0.54   -10.39    16.68       5.35       0.09   -10.30     16
  10       N    -0.62    -7.08     3.34    -176.54      -0.59    -7.67     16
  11       C     0.09     0.73     4.89      -2.87      -0.01     0.72     16
  12       C    -0.12    -0.45     6.35     -25.51      -0.16    -0.61     16
  13       C    -0.10    -0.38     0.93    -154.49      -0.14    -0.52     16
  14       C    -0.08    -0.01     7.01     -26.53      -0.19    -0.19     16
  15       C    -0.17    -0.47     3.18     -89.57      -0.29    -0.76     16
  16       C     0.39     0.91     9.52      37.15       0.35     1.27     16
  17       O    -0.70   -10.27    16.57     -57.73      -0.96   -11.23     16
  18       O    -0.74   -11.36    17.78     -57.73      -1.03   -12.39     16
  19       C    -0.11    -0.54     6.95     -26.41      -0.18    -0.72     16
  20       C     0.13     1.06     6.15      -3.12      -0.02     1.04     16
  21       C    -0.14    -2.39     8.58     -39.24      -0.34    -2.73     16
  22       C    -0.10    -2.08     9.58     -39.20      -0.38    -2.46     16
  23       H     0.13     3.11     7.63     -52.48      -0.40     2.71     16
  24       H     0.13     2.34     7.66     -52.49      -0.40     1.94     16
  25       H     0.09     0.75     6.65     -51.93      -0.35     0.40     16
  26       H     0.08     0.67     6.81     -51.93      -0.35     0.32     16
  27       H     0.09     0.20     8.00     -51.93      -0.42    -0.21     16
  28       H     0.09     0.22     8.14     -51.93      -0.42    -0.21     16
  29       H     0.10    -0.27     8.10     -51.93      -0.42    -0.69     16
  30       H     0.10    -0.05     8.12     -51.93      -0.42    -0.48     16
  31       H     0.14     0.74     7.78     -51.93      -0.40     0.34     16
  32       H     0.14    -0.21     8.14     -51.93      -0.42    -0.63     16
  33       H     0.14    -0.14     7.88     -51.93      -0.41    -0.55     16
  34       H     0.33     4.45     8.90      45.56       0.41     4.86     16
  35       H     0.33     4.51     8.90      45.56       0.41     4.92     16
  36       H     0.09     0.79     8.13     -51.93      -0.42     0.36     16
  37       H     0.10     0.28     7.83     -51.93      -0.41    -0.12     16
  38       H     0.07     0.53     8.14     -51.93      -0.42     0.11     16
  39       H     0.08     0.81     8.04     -51.93      -0.42     0.39     16
  40       H     0.15     1.85     2.74     -58.45      -0.16     1.69     16
  41       H     0.13     2.80     7.63     -52.49      -0.40     2.40     16
 Total:         -1.00   -50.00   343.96                 -7.00   -57.00