COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.216   0.824  -0.079  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.890  -0.405  -0.048  1.00  0.00           C  
HETATM    3  C   UNL     1       1.796   2.126  -0.149  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.352   1.991  -0.041  1.00  0.00           C  
HETATM    5  C   UNL     1       3.937  -1.380  -0.901  1.00  0.00           C  
HETATM    6  C   UNL     1       5.456  -1.231  -1.022  1.00  0.00           C  
HETATM    7  C   UNL     1       1.197   0.881  -0.120  1.00  0.00           C  
HETATM    8  C   UNL     1       3.353  -0.100  -0.298  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.554  -3.193   1.274  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.101  -2.803  -0.101  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.954  -3.946  -0.653  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.902  -1.626   0.021  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.254  -0.433  -0.009  1.00  0.00           C  
HETATM   14  C   UNL     1       1.006   3.272  -0.137  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.303   3.208  -0.106  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.949   2.036  -0.076  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.996   0.765   0.001  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.472   0.714   0.038  1.00  0.00           C  
HETATM   19  O   UNL     1      -5.042  -0.359   0.075  1.00  0.00           O  
HETATM   20  N   UNL     1      -5.186   1.857   0.030  1.00  0.00           N  
HETATM   21  O   UNL     1       1.942  -0.252  -0.130  1.00  0.00           O  
HETATM   22  C   UNL     1       6.046  -0.938   0.360  1.00  0.00           C  
HETATM   23  N   UNL     1       5.456   0.296   0.894  1.00  0.00           N  
HETATM   24  C   UNL     1       4.004   0.160   1.063  1.00  0.00           C  
HETATM   25  H   UNL     1      -0.330  -1.328  -0.056  1.00  0.00           H  
HETATM   26  H   UNL     1       2.872   2.210  -0.180  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.925   2.906  -0.047  1.00  0.00           H  
HETATM   28  H   UNL     1       3.508  -1.546  -1.889  1.00  0.00           H  
HETATM   29  H   UNL     1       3.704  -2.227  -0.255  1.00  0.00           H  
HETATM   30  H   UNL     1       5.883  -2.155  -1.411  1.00  0.00           H  
HETATM   31  H   UNL     1       5.689  -0.409  -1.698  1.00  0.00           H  
HETATM   32  H   UNL     1       3.552   0.740  -0.963  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.942  -4.090   1.181  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.946  -2.378   1.667  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.384  -3.387   1.953  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.270  -2.608  -0.780  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.784  -4.141   0.026  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.344  -3.669  -1.633  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.343  -4.844  -0.746  1.00  0.00           H  
HETATM   40  H   UNL     1       1.485   4.240  -0.161  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.731   2.713   0.001  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.155   1.823   0.054  1.00  0.00           H  
HETATM   43  H   UNL     1       5.825  -1.767   1.032  1.00  0.00           H  
HETATM   44  H   UNL     1       7.126  -0.817   0.275  1.00  0.00           H  
HETATM   45  H   UNL     1       5.680   1.087   0.308  1.00  0.00           H  
HETATM   46  H   UNL     1       3.600   1.079   1.489  1.00  0.00           H  
HETATM   47  H   UNL     1       3.792  -0.674   1.732  1.00  0.00           H  
CONECT    1    7   16   16    2                                       
CONECT    2    1   13   13   25                                       
CONECT    3   14    7    7   26                                       
CONECT    4   16   17   17   27                                       
CONECT    5    8    6   28   29                                       
CONECT    6    5   22   30   31                                       
CONECT    7    3    3   21    1                                       
CONECT    8    5   21   24   32                                       
CONECT    9   10   33   34   35                                       
CONECT   10   12   11    9   36                                       
CONECT   11   10   37   38   39                                       
CONECT   12   13   10                                                 
CONECT   13   17    2    2   12                                       
CONECT   14   15   15    3   40                                       
CONECT   15   14   14   16                                            
CONECT   16   15    4    1    1                                       
CONECT   17    4    4   18   13                                       
CONECT   18   19   19   17   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   41   42                                            
CONECT   21    7    8                                                 
CONECT   22    6   23   43   44                                       
CONECT   23   24   22   45                                            
CONECT   24    8   23   46   47                                       
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
