COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.208  -0.096   0.773  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.465   0.493   1.981  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.593   1.288   2.164  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.104  -0.869   0.609  1.00  0.00           O  
HETATM    5  C   UNL     1      -4.248   0.918  -0.105  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.124   1.107  -1.186  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.810  -0.234  -2.543  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.898  -0.474  -1.561  1.00  0.00           C  
HETATM    9  C   UNL     1       0.933  -1.925   1.367  1.00  0.00           C  
HETATM   10  C   UNL     1       0.417  -3.242   0.751  1.00  0.00           C  
HETATM   11  C   UNL     1       1.443  -3.522  -0.379  1.00  0.00           C  
HETATM   12  C   UNL     1       1.763  -2.088  -0.871  1.00  0.00           C  
HETATM   13  C   UNL     1       3.038   1.831   1.830  1.00  0.00           C  
HETATM   14  C   UNL     1       2.353   0.626   1.704  1.00  0.00           C  
HETATM   15  C   UNL     1       3.826   1.645  -0.337  1.00  0.00           C  
HETATM   16  N   UNL     1       3.170   0.459  -0.507  1.00  0.00           N  
HETATM   17  N   UNL     1       4.460   1.909  -1.474  1.00  0.00           N  
HETATM   18  C   UNL     1      -4.476   1.505   1.149  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.102   0.103  -0.295  1.00  0.00           C  
HETATM   20  N   UNL     1      -4.870   0.537  -2.341  1.00  0.00           N  
HETATM   21  N   UNL     1       1.762  -1.261   0.350  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.248  -1.028   1.742  1.00  0.00           C  
HETATM   23  C   UNL     1       2.426  -0.066   0.511  1.00  0.00           C  
HETATM   24  N   UNL     1       3.746   2.304   0.825  1.00  0.00           N  
HETATM   25  N   UNL     1       3.452   0.033  -1.811  1.00  0.00           N  
HETATM   26  C   UNL     1       4.231   0.939  -2.350  1.00  0.00           C  
HETATM   27  H   UNL     1      -1.783   0.339   2.804  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.772   1.741   3.128  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.006   1.719  -1.068  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.659  -0.673  -3.518  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.041  -1.105  -1.746  1.00  0.00           H  
HETATM   32  H   UNL     1       1.532  -2.137   2.253  1.00  0.00           H  
HETATM   33  H   UNL     1       0.428  -4.044   1.489  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.583  -3.109   0.339  1.00  0.00           H  
HETATM   35  H   UNL     1       2.335  -4.008   0.015  1.00  0.00           H  
HETATM   36  H   UNL     1       0.995  -4.116  -1.175  1.00  0.00           H  
HETATM   37  H   UNL     1       2.743  -2.060  -1.347  1.00  0.00           H  
HETATM   38  H   UNL     1       0.996  -1.744  -1.564  1.00  0.00           H  
HETATM   39  H   UNL     1       2.986   2.384   2.756  1.00  0.00           H  
HETATM   40  H   UNL     1       1.773   0.237   2.528  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.344   2.127   1.308  1.00  0.00           H  
HETATM   42  H   UNL     1       0.122  -0.052   2.057  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.807  -1.485   2.558  1.00  0.00           H  
HETATM   44  H   UNL     1       4.626   0.901  -3.355  1.00  0.00           H  
CONECT    1    4   19   19    2                                       
CONECT    2    1    3    3   27                                       
CONECT    3    2    2   18   28                                       
CONECT    4   22    1                                                 
CONECT    5   19    6   18   18                                       
CONECT    6   20   20    5   29                                       
CONECT    7    8    8   20   30                                       
CONECT    8    7    7   19   31                                       
CONECT    9   10   21   22   32                                       
CONECT   10    9   11   33   34                                       
CONECT   11   10   12   35   36                                       
CONECT   12   11   21   37   38                                       
CONECT   13   24   24   14   39                                       
CONECT   14   13   23   23   40                                       
CONECT   15   24   17   17   16                                       
CONECT   16   15   23   25                                            
CONECT   17   15   15   26                                            
CONECT   18    5    5    3   41                                       
CONECT   19    8    1    1    5                                       
CONECT   20    7    6    6                                            
CONECT   21    9   23   12                                            
CONECT   22    9    4   42   43                                       
CONECT   23   14   14   21   16                                       
CONECT   24   13   13   15                                            
CONECT   25   16   26   26                                            
CONECT   26   17   25   25   44                                       
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   18                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   26                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
