COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.067  -0.227   0.097  1.00  0.00           C  
HETATM    2  C   UNL     1       0.002   2.883   1.048  1.00  0.00           C  
HETATM    3  C   UNL     1       2.093   0.730   0.090  1.00  0.00           C  
HETATM    4  C   UNL     1       0.906   0.524   0.797  1.00  0.00           C  
HETATM    5  C   UNL     1       5.821   1.694  -1.566  1.00  0.00           C  
HETATM    6  C   UNL     1       3.930  -2.446   0.824  1.00  0.00           C  
HETATM    7  C   UNL     1       4.351  -0.002  -0.661  1.00  0.00           C  
HETATM    8  C   UNL     1       4.080   0.052  -2.178  1.00  0.00           C  
HETATM    9  C   UNL     1       5.014   1.130  -2.754  1.00  0.00           C  
HETATM   10  C   UNL     1       4.937   1.393  -0.330  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.149   1.561   0.789  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.468   2.795   0.424  1.00  0.00           N  
HETATM   13  C   UNL     1       2.876  -1.414   0.811  1.00  0.00           C  
HETATM   14  C   UNL     1       0.714  -0.661   1.511  1.00  0.00           C  
HETATM   15  C   UNL     1       1.685  -1.623   1.513  1.00  0.00           C  
HETATM   16  O   UNL     1       4.176  -3.143   1.950  1.00  0.00           O  
HETATM   17  O   UNL     1       4.576  -2.667  -0.181  1.00  0.00           O  
HETATM   18  O   UNL     1      -1.182   3.507   0.951  1.00  0.00           O  
HETATM   19  C   UNL     1      -2.166   2.643   0.626  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.582   1.371   0.499  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.371   0.277   0.163  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.735   0.492  -0.038  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.245   1.783   0.106  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.630  -0.636  -0.399  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.991  -0.412  -0.598  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.818  -1.464  -0.934  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.299  -2.739  -1.073  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.949  -2.966  -0.877  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.111  -1.920  -0.547  1.00  0.00           C  
HETATM   30  H   UNL     1       0.936   3.362   1.301  1.00  0.00           H  
HETATM   31  H   UNL     1       2.240   1.647  -0.461  1.00  0.00           H  
HETATM   32  H   UNL     1       6.781   1.186  -1.481  1.00  0.00           H  
HETATM   33  H   UNL     1       5.967   2.768  -1.680  1.00  0.00           H  
HETATM   34  H   UNL     1       5.072  -0.785  -0.429  1.00  0.00           H  
HETATM   35  H   UNL     1       4.301  -0.915  -2.631  1.00  0.00           H  
HETATM   36  H   UNL     1       3.039   0.321  -2.363  1.00  0.00           H  
HETATM   37  H   UNL     1       4.428   1.923  -3.218  1.00  0.00           H  
HETATM   38  H   UNL     1       5.689   0.687  -3.486  1.00  0.00           H  
HETATM   39  H   UNL     1       5.541   1.354   0.576  1.00  0.00           H  
HETATM   40  H   UNL     1       4.142   2.133  -0.234  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.204  -0.820   2.057  1.00  0.00           H  
HETATM   42  H   UNL     1       1.536  -2.539   2.065  1.00  0.00           H  
HETATM   43  H   UNL     1       4.876  -3.809   1.910  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.941  -0.709   0.060  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.300   1.955  -0.049  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.397   0.583  -0.489  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.873  -1.292  -1.088  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.951  -3.559  -1.335  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.549  -3.964  -0.987  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.056  -2.098  -0.398  1.00  0.00           H  
CONECT    1    3    3   13    7                                       
CONECT    2   18   11   11   30                                       
CONECT    3    4    1    1   31                                       
CONECT    4   11   14   14    3                                       
CONECT    5   10    9   32   33                                       
CONECT    6   13   17   17   16                                       
CONECT    7   10    1    8   34                                       
CONECT    8    7    9   35   36                                       
CONECT    9    5    8   37   38                                       
CONECT   10    5    7   39   40                                       
CONECT   11    2    2   20    4                                       
CONECT   12   19   19   23                                            
CONECT   13   15   15    1    6                                       
CONECT   14    4    4   15   41                                       
CONECT   15   14   13   13   42                                       
CONECT   16    6   43                                                 
CONECT   17    6    6                                                 
CONECT   18   19    2                                                 
CONECT   19   18   12   12   20                                       
CONECT   20   19   11   21   21                                       
CONECT   21   20   20   22   44                                       
CONECT   22   23   23   21   24                                       
CONECT   23   12   22   22   45                                       
CONECT   24   22   29   29   25                                       
CONECT   25   24   26   26   46                                       
CONECT   26   25   25   27   47                                       
CONECT   27   28   28   26   48                                       
CONECT   28   29   27   27   49                                       
CONECT   29   24   24   28   50                                       
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
