REAL300009850699.mol2 38                                                        
   1       C     0.02     0.36    10.15     101.05       1.03     1.39     16
   2       O    -0.36    -8.51     9.71     -64.72      -0.63    -9.14     16
   3       C     0.02     0.55     0.91     -92.92      -0.08     0.47     16
   4       C    -0.16    -2.87     8.06      37.16       0.30    -2.57     16
   5       C     0.49    13.86     6.46      36.01       0.23    14.09     16
   6       O    -0.66   -20.78    14.79     -26.63      -0.39   -21.17     16
   7       O    -0.68   -19.69    16.46     -20.23      -0.33   -20.02     16
   8       C     0.55    11.72     6.27     -10.98      -0.07    11.66     16
   9       O    -0.51   -11.61    14.17     -14.35      -0.20   -11.81     16
  10       N    -0.66   -11.39     4.91      -9.88      -0.05   -11.44     16
  11       C     0.21     3.00     6.26     -83.75      -0.52     2.48     16
  12       C    -0.16    -1.64     9.69     -38.96      -0.38    -2.02     16
  13       C    -0.02    -0.24     5.74    -106.77      -0.61    -0.85     16
  14       C    -0.06    -0.40     9.73     -39.53      -0.38    -0.79     16
  15       C    -0.11    -1.02     9.65     -39.64      -0.38    -1.40     16
  16       C     0.32     3.79     9.78     -38.67      -0.38     3.41     16
  17       O    -0.69   -12.36    17.19     -57.73      -0.99   -13.35     16
  18       O    -0.69   -12.14    17.20     -57.73      -0.99   -13.13     16
  19       C    -0.08    -0.79     9.49     -38.78      -0.37    -1.16     16
  20       C    -0.04    -0.45     5.74    -106.81      -0.61    -1.06     16
  21       C    -0.08    -0.84     9.74     -39.48      -0.38    -1.22     16
  22       C    -0.10    -1.38     8.55     -39.75      -0.34    -1.72     16
  23       H     0.03     0.45     6.42     -51.93      -0.33     0.12     16
  24       H     0.09     2.04     5.41     -51.93      -0.28     1.76     16
  25       H     0.07     1.27     8.14     -51.93      -0.42     0.85     16
  26       H     0.07     1.20     7.40     -51.93      -0.38     0.82     16
  27       H     0.07     1.25     6.54     -51.93      -0.34     0.91     16
  28       H     0.06     0.94     8.14     -51.93      -0.42     0.51     16
  29       H     0.43     6.99     7.07     -40.82      -0.29     6.71     16
  30       H     0.15     1.12     8.06     -52.49      -0.42     0.70     16
  31       H     0.17     0.61     8.06     -52.49      -0.42     0.19     16
  32       H     0.17     1.40     7.73     -52.48      -0.41     1.00     16
  33       H     0.33     4.97     8.90      45.56       0.41     5.38     16
  34       H     0.33     4.88     8.90      45.56       0.41     5.29     16
  35       H     0.18     1.76     7.73     -52.49      -0.41     1.35     16
  36       H     0.15     1.25     8.06     -52.49      -0.42     0.83     16
  37       H     0.15     2.53     6.39     -52.48      -0.34     2.19     16
 Total:         -1.00   -40.15   323.60                 -5.75   -45.90