COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.190  -1.340  -4.201  1.00  0.00           O  
HETATM    2  C   UNL     1       0.484  -0.646  -3.495  1.00  0.00           C  
HETATM    3  N   UNL     1      -0.714  -0.249  -3.955  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.145  -0.660  -5.294  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.889  -1.968  -5.203  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.134  -2.042  -5.604  1.00  0.00           C  
HETATM    7  N   UNL     1       0.923  -0.293  -2.272  1.00  0.00           N  
HETATM    8  C   UNL     1       2.237  -0.746  -1.808  1.00  0.00           C  
HETATM    9  C   UNL     1       3.300   0.279  -2.204  1.00  0.00           C  
HETATM   10  C   UNL     1       4.672  -0.193  -1.720  1.00  0.00           C  
HETATM   11  C   UNL     1       5.735   0.833  -2.117  1.00  0.00           C  
HETATM   12  C   UNL     1       0.132   0.491  -1.449  1.00  0.00           C  
HETATM   13  N   UNL     1       0.287   0.996  -0.223  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.107   0.912  -1.914  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.527   0.520  -3.203  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.612   0.872  -3.631  1.00  0.00           O  
HETATM   17  N   UNL     1      -1.661   1.672  -0.903  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.770   1.692   0.107  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.962   2.408   1.419  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.904   1.412   2.548  1.00  0.00           C  
HETATM   21  C   UNL     1       0.306   1.121   3.149  1.00  0.00           C  
HETATM   22  C   UNL     1       0.363   0.209   4.184  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.796  -0.415   4.622  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.011  -0.120   4.016  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.062   0.796   2.985  1.00  0.00           C  
HETATM   26  N   UNL     1      -0.742  -1.339   5.671  1.00  0.00           N  
HETATM   27  C   UNL     1       0.151  -1.177   6.667  1.00  0.00           C  
HETATM   28  O   UNL     1       0.840  -0.180   6.706  1.00  0.00           O  
HETATM   29  C   UNL     1       0.294  -2.235   7.730  1.00  0.00           C  
HETATM   30  H   UNL     1      -1.800   0.101  -5.715  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.271  -0.783  -5.935  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.396  -2.843  -4.807  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.667  -2.979  -5.539  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.627  -1.166  -6.000  1.00  0.00           H  
HETATM   35  H   UNL     1       2.472  -1.708  -2.265  1.00  0.00           H  
HETATM   36  H   UNL     1       2.222  -0.854  -0.723  1.00  0.00           H  
HETATM   37  H   UNL     1       3.065   1.241  -1.748  1.00  0.00           H  
HETATM   38  H   UNL     1       3.314   0.386  -3.289  1.00  0.00           H  
HETATM   39  H   UNL     1       4.907  -1.154  -2.177  1.00  0.00           H  
HETATM   40  H   UNL     1       4.657  -0.300  -0.635  1.00  0.00           H  
HETATM   41  H   UNL     1       6.712   0.496  -1.771  1.00  0.00           H  
HETATM   42  H   UNL     1       5.749   0.940  -3.201  1.00  0.00           H  
HETATM   43  H   UNL     1       5.499   1.794  -1.660  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.527   2.107  -0.917  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.174   3.150   1.547  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.932   2.905   1.422  1.00  0.00           H  
HETATM   47  H   UNL     1       1.208   1.607   2.808  1.00  0.00           H  
HETATM   48  H   UNL     1       1.309  -0.018   4.653  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.915  -0.605   4.354  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.006   1.025   2.513  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.348  -2.097   5.682  1.00  0.00           H  
HETATM   52  H   UNL     1       1.060  -1.931   8.444  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.655  -2.361   8.248  1.00  0.00           H  
HETATM   54  H   UNL     1       0.584  -3.179   7.267  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    7                                       
CONECT    3    2    4   15                                            
CONECT    4    3    5   30   31                                       
CONECT    5    4    6    6   32                                       
CONECT    6    5    5   33   34                                       
CONECT    7    2    8   12                                            
CONECT    8    7    9   35   36                                       
CONECT    9    8   10   37   38                                       
CONECT   10    9   11   39   40                                       
CONECT   11   10   41   42   43                                       
CONECT   12    7   13   14   14                                       
CONECT   13   12   18   18                                            
CONECT   14   12   12   15   17                                       
CONECT   15    3   14   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   14   18   44                                            
CONECT   18   13   13   17   19                                       
CONECT   19   18   20   45   46                                       
CONECT   20   19   21   21   25                                       
CONECT   21   20   20   22   47                                       
CONECT   22   21   23   23   48                                       
CONECT   23   22   22   24   26                                       
CONECT   24   23   25   25   49                                       
CONECT   25   20   24   24   50                                       
CONECT   26   23   27   51                                            
CONECT   27   26   28   28   29                                       
CONECT   28   27   27                                                 
CONECT   29   27   52   53   54                                       
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
