COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.444   2.048   0.587  1.00  0.00           C  
HETATM    2  N   UNL     1       4.181   1.362   0.891  1.00  0.00           N  
HETATM    3  C   UNL     1       3.093   2.328   1.094  1.00  0.00           C  
HETATM    4  C   UNL     1       3.839   0.397  -0.163  1.00  0.00           C  
HETATM    5  C   UNL     1       2.666  -0.469   0.299  1.00  0.00           C  
HETATM    6  O   UNL     1       1.455   0.316   0.359  1.00  0.00           O  
HETATM    7  C   UNL     1       0.377  -0.643   0.308  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.863   0.006  -0.126  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.109  -0.179   0.417  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.601  -0.916   1.408  1.00  0.00           N  
HETATM   11  C   UNL     1      -3.884  -0.877   1.700  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.739  -0.119   1.038  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.340   0.652   0.032  1.00  0.00           C  
HETATM   14  N   UNL     1      -5.243   1.443  -0.656  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.978   0.645  -0.317  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.231   1.279  -1.253  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.989   0.909  -1.139  1.00  0.00           C  
HETATM   18  C   UNL     1       0.829  -1.690  -0.734  1.00  0.00           C  
HETATM   19  O   UNL     1       0.428  -3.001  -0.333  1.00  0.00           O  
HETATM   20  C   UNL     1       2.369  -1.572  -0.740  1.00  0.00           C  
HETATM   21  O   UNL     1       2.967  -2.808  -0.343  1.00  0.00           O  
HETATM   22  C   UNL     1       0.143   1.403  -2.002  1.00  0.00           C  
HETATM   23  H   UNL     1       5.349   2.582  -0.358  1.00  0.00           H  
HETATM   24  H   UNL     1       5.674   2.756   1.383  1.00  0.00           H  
HETATM   25  H   UNL     1       6.247   1.314   0.511  1.00  0.00           H  
HETATM   26  H   UNL     1       2.960   2.920   0.189  1.00  0.00           H  
HETATM   27  H   UNL     1       2.170   1.793   1.317  1.00  0.00           H  
HETATM   28  H   UNL     1       3.342   2.986   1.926  1.00  0.00           H  
HETATM   29  H   UNL     1       3.560   0.933  -1.070  1.00  0.00           H  
HETATM   30  H   UNL     1       4.701  -0.238  -0.367  1.00  0.00           H  
HETATM   31  H   UNL     1       2.882  -0.911   1.272  1.00  0.00           H  
HETATM   32  H   UNL     1       0.240  -1.112   1.282  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.251  -1.489   2.511  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.180   1.439  -0.406  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.939   2.001  -1.389  1.00  0.00           H  
HETATM   36  H   UNL     1       0.424  -1.449  -1.717  1.00  0.00           H  
HETATM   37  H   UNL     1       0.687  -3.698  -0.952  1.00  0.00           H  
HETATM   38  H   UNL     1       2.726  -1.274  -1.726  1.00  0.00           H  
HETATM   39  H   UNL     1       2.813  -3.536  -0.960  1.00  0.00           H  
HETATM   40  H   UNL     1       0.246   0.756  -2.873  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.068   2.422  -2.330  1.00  0.00           H  
HETATM   42  H   UNL     1       1.070   1.391  -1.429  1.00  0.00           H  
CONECT    1    2   23   24   25                                       
CONECT    2    1    3    4                                            
CONECT    3    2   26   27   28                                       
CONECT    4    2    5   29   30                                       
CONECT    5    4    6   20   31                                       
CONECT    6    5    7                                                 
CONECT    7    6    8   18   32                                       
CONECT    8    7   17    9                                            
CONECT    9    8   15   15   10                                       
CONECT   10    9   11   11                                            
CONECT   11   10   10   12   33                                       
CONECT   12   11   13   13                                            
CONECT   13   12   12   15   14                                       
CONECT   14   13   34   35                                            
CONECT   15    9    9   13   16                                       
CONECT   16   15   17   17                                            
CONECT   17    8   16   16   22                                       
CONECT   18    7   19   20   36                                       
CONECT   19   18   37                                                 
CONECT   20    5   18   21   38                                       
CONECT   21   20   39                                                 
CONECT   22   17   40   41   42                                       
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33   11                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
