COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.063   0.089  -0.293  1.00  0.00           C  
HETATM    2  C   UNL     1       4.838  -1.032  -0.059  1.00  0.00           C  
HETATM    3  C   UNL     1       6.199  -0.875   0.229  1.00  0.00           C  
HETATM    4  C   UNL     1       6.761   0.428   0.286  1.00  0.00           C  
HETATM    5  C   UNL     1       5.945   1.546   0.048  1.00  0.00           C  
HETATM    6  C   UNL     1       4.627   1.374  -0.234  1.00  0.00           C  
HETATM    7  C   UNL     1       7.043  -1.975   0.473  1.00  0.00           C  
HETATM    8  C   UNL     1       8.356  -1.743   0.752  1.00  0.00           C  
HETATM    9  N   UNL     1       8.854  -0.515   0.799  1.00  0.00           N  
HETATM   10  C   UNL     1       8.127   0.556   0.582  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.493  -1.556  -0.079  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.912  -1.208   1.122  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.606  -0.709   1.149  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.912  -0.577  -0.061  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.499  -0.924  -1.249  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.793  -1.417  -1.264  1.00  0.00           C  
HETATM   17  N   UNL     1      -5.817  -0.298   2.187  1.00  0.00           N  
HETATM   18  C   UNL     1      -4.651   0.107   1.830  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.561  -0.020   0.323  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.011  -0.422  -1.226  1.00  0.00           C  
HETATM   21  N   UNL     1       0.903  -1.238  -1.714  1.00  0.00           N  
HETATM   22  C   UNL     1       2.183  -1.096  -1.435  1.00  0.00           C  
HETATM   23  C   UNL     1       2.620  -0.066  -0.604  1.00  0.00           C  
HETATM   24  C   UNL     1       1.681   0.820  -0.072  1.00  0.00           C  
HETATM   25  C   UNL     1       0.342   0.628  -0.390  1.00  0.00           C  
HETATM   26  O   UNL     1      -0.609   1.462   0.107  1.00  0.00           O  
HETATM   27  C   UNL     1      -1.864   1.008  -0.403  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.984   1.908   0.121  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.338   1.350  -0.323  1.00  0.00           C  
HETATM   30  N   UNL     1      -2.814   3.265  -0.417  1.00  0.00           N  
HETATM   31  H   UNL     1       4.399  -2.018  -0.101  1.00  0.00           H  
HETATM   32  H   UNL     1       6.364   2.541   0.089  1.00  0.00           H  
HETATM   33  H   UNL     1       4.005   2.238  -0.417  1.00  0.00           H  
HETATM   34  H   UNL     1       6.657  -2.984   0.439  1.00  0.00           H  
HETATM   35  H   UNL     1       9.009  -2.582   0.940  1.00  0.00           H  
HETATM   36  H   UNL     1       8.580   1.535   0.631  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.502  -1.942  -0.094  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.466  -1.320   2.042  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.951  -0.815  -2.174  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.256  -1.693  -2.201  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.874   0.472   2.486  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.766  -0.710   0.041  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.050  -0.574  -1.479  1.00  0.00           H  
HETATM   44  H   UNL     1       2.900  -1.785  -1.855  1.00  0.00           H  
HETATM   45  H   UNL     1       1.986   1.629   0.575  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.039  -0.017  -0.077  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.848   1.044  -1.492  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.944   1.942   1.210  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.131   2.030  -0.013  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.350   1.246  -1.408  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.951   3.200  -1.414  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.576   3.818  -0.055  1.00  0.00           H  
CONECT    1    2    2    6   23                                       
CONECT    2    1    1    3   31                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5   10                                       
CONECT    5    4    6    6   32                                       
CONECT    6    1    5    5   33                                       
CONECT    7    3    8    8   34                                       
CONECT    8    7    7    9   35                                       
CONECT    9    8   10   10                                            
CONECT   10    4    9    9   36                                       
CONECT   11   12   12   16   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   12   14   14   17                                       
CONECT   14   13   13   15   19                                       
CONECT   15   14   16   16   39                                       
CONECT   16   11   15   15   40                                       
CONECT   17   13   18   18                                            
CONECT   18   17   17   19   41                                       
CONECT   19   14   18   29   42                                       
CONECT   20   21   25   25   43                                       
CONECT   21   20   22   22                                            
CONECT   22   21   21   23   44                                       
CONECT   23    1   22   24   24                                       
CONECT   24   23   23   25   45                                       
CONECT   25   20   20   24   26                                       
CONECT   26   25   27                                                 
CONECT   27   26   28   46   47                                       
CONECT   28   27   29   30   48                                       
CONECT   29   19   28   49   50                                       
CONECT   30   28   51   52                                            
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
