REAL300018446686.mol2 40                                                        
   1       O    -0.69   -25.02    17.82     -20.55      -0.37   -25.38     16
   2       C     0.56    19.88     8.05      34.44       0.28    20.15     16
   3       O    -0.68   -25.98    17.99     -20.56      -0.37   -26.35     16
   4       C    -0.01    -0.33     7.13     -82.74      -0.59    -0.92     16
   5       N    -0.27    -7.18    12.03      33.42       0.40    -6.77     16
   6       N    -0.31    -6.53     3.76     -56.59      -0.21    -6.74     16
   7       C     0.13     1.87     7.18      -3.70      -0.03     1.85     16
   8       C    -0.13    -1.43     5.91     -26.58      -0.16    -1.59     16
   9       C    -0.12    -1.50     5.27     -26.43      -0.14    -1.64     16
  10       C     0.17     2.59     2.87     -68.59      -0.20     2.39     16
  11       N    -0.66    -9.35     6.00    -108.92      -0.65   -10.01     16
  12       C     0.09     1.20     4.63      -4.98      -0.02     1.18     16
  13       C    -0.06    -0.67     5.42    -104.29      -0.57    -1.23     16
  14       C    -0.06    -0.51     9.66     -39.63      -0.38    -0.89     16
  15       C    -0.11    -0.58    10.04     -39.49      -0.40    -0.98     16
  16       C    -0.08    -0.38    10.03     -39.63      -0.40    -0.78     16
  17       C    -0.11    -0.90     9.75     -39.25      -0.38    -1.29     16
  18       C     0.32     3.67     9.76     -38.72      -0.38     3.29     16
  19       O    -0.66    -9.93    12.46     -57.73      -0.72   -10.65     16
  20       O    -0.70   -11.80    17.25     -57.73      -1.00   -12.79     16
  21       C     0.00    -0.09     6.28     -81.94      -0.51    -0.60     16
  22       C    -0.18    -4.38     9.98     -39.52      -0.39    -4.78     16
  23       H     0.08     1.09     8.14     -51.93      -0.42     0.66     16
  24       H     0.09     1.25     8.14     -51.93      -0.42     0.83     16
  25       H     0.09     0.72     8.14     -51.93      -0.42     0.29     16
  26       H     0.07     0.85     8.11     -51.93      -0.42     0.43     16
  27       H     0.07     0.78     8.14     -51.93      -0.42     0.36     16
  28       H     0.08     0.97     8.12     -51.93      -0.42     0.55     16
  29       H     0.06     0.95     7.82     -51.93      -0.41     0.55     16
  30       H     0.35     4.92     6.95     -39.29      -0.27     4.65     16
  31       H     0.09     1.26     5.72     -51.93      -0.30     0.96     16
  32       H     0.10     1.45     5.14     -51.93      -0.27     1.18     16
  33       H     0.18     1.53     8.03     -52.49      -0.42     1.10     16
  34       H     0.16     0.47     8.06     -52.49      -0.42     0.05     16
  35       H     0.16     0.23     8.06     -52.48      -0.42    -0.20     16
  36       H     0.17     1.28     7.77     -52.49      -0.41     0.87     16
  37       H     0.33     4.30     8.90      45.56       0.41     4.71     16
  38       H     0.33     4.68     8.90      45.56       0.41     5.08     16
  39       H     0.14     3.18     5.84     -52.48      -0.31     2.88     16
 Total:         -1.00   -47.44   329.30                 -7.17   -54.61