REAL300018043473.mol2 39                                                        
   1       O    -0.68   -22.61    17.27     -20.60      -0.36   -22.97     16
   2       C     0.52    16.23     7.97      34.33       0.27    16.50     16
   3       O    -0.67   -22.05    14.45     -20.60      -0.30   -22.34     16
   4       C    -0.07    -1.65     6.04    -102.85      -0.62    -2.27     16
   5       C    -0.16    -3.23     8.82     -38.88      -0.34    -3.58     16
   6       C     0.21     3.47     6.62     -83.98      -0.56     2.91     16
   7       N    -0.75    -8.19     5.72     -59.95      -0.34    -8.53     16
   8       C     0.16     1.44     5.00      -5.20      -0.03     1.41     16
   9       C    -0.09    -0.53     5.26    -104.52      -0.55    -1.08     16
  10       C    -0.06    -0.30     9.68     -39.63      -0.38    -0.68     16
  11       C    -0.11    -0.76     9.75     -39.25      -0.38    -1.15     16
  12       C     0.33     3.11     9.80     -38.72      -0.38     2.73     16
  13       O    -0.68   -10.84    17.25     -57.73      -1.00   -11.84     16
  14       O    -0.68   -10.84    17.25     -57.73      -1.00   -11.84     16
  15       C    -0.11    -0.76     9.75     -39.25      -0.38    -1.14     16
  16       C    -0.06    -0.30     9.68     -39.63      -0.38    -0.68     16
  17       C    -0.22    -3.59     9.55     -38.93      -0.37    -3.96     16
  18       C    -0.01    -0.20     5.74    -106.88      -0.61    -0.81     16
  19       C    -0.15    -2.42     9.77     -39.44      -0.39    -2.81     16
  20       C    -0.11    -1.72     9.95     -39.95      -0.40    -2.12     16
  21       C    -0.17    -3.11     9.96     -39.89      -0.40    -3.51     16
  22       C    -0.07    -1.59     9.27     -39.62      -0.37    -1.96     16
  23       C    -0.07    -1.72     5.90    -104.74      -0.62    -2.34     16
  24       H     0.13     2.62     6.19     -52.48      -0.32     2.30     16
  25       H     0.40     3.45     8.45     -40.82      -0.34     3.11     16
  26       H     0.08     0.76     7.84     -51.93      -0.41     0.35     16
  27       H     0.08     0.76     7.85     -51.93      -0.41     0.36     16
  28       H     0.17     0.62     8.06     -52.48      -0.42     0.19     16
  29       H     0.17     1.19     7.77     -52.49      -0.41     0.78     16
  30       H     0.33     4.39     8.90      45.56       0.41     4.80     16
  31       H     0.33     4.39     8.90      45.56       0.41     4.80     16
  32       H     0.17     1.19     7.77     -52.49      -0.41     0.78     16
  33       H     0.17     0.61     8.06     -52.49      -0.42     0.19     16
  34       H     0.11     1.50     8.06     -52.49      -0.42     1.08     16
  35       H     0.11     1.52     8.06     -52.49      -0.42     1.10     16
  36       H     0.11     1.40     8.06     -52.48      -0.42     0.98     16
  37       H     0.11     1.77     8.06     -52.49      -0.42     1.35     16
  38       H     0.17     4.38     5.02     -52.48      -0.26     4.11     16
 Total:         -1.00   -41.61   337.49                 -9.08   -50.68