COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.648  -0.618   0.747  1.00  0.00           C  
HETATM    2  C   UNL     1       6.383  -1.426   0.951  1.00  0.00           C  
HETATM    3  C   UNL     1       5.671  -1.326  -0.415  1.00  0.00           C  
HETATM    4  C   UNL     1       4.177  -1.425  -0.274  1.00  0.00           C  
HETATM    5  C   UNL     1       2.118  -0.350   0.392  1.00  0.00           C  
HETATM    6  C   UNL     1       1.479  -0.595  -0.976  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.034  -0.757  -0.810  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.618   0.516  -0.194  1.00  0.00           C  
HETATM    9  C   UNL     1       0.021   0.761   1.174  1.00  0.00           C  
HETATM   10  C   UNL     1       1.533   0.923   1.008  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.882   1.478  -0.002  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.138   3.771   0.030  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.065   2.514   0.072  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.450   0.749   0.099  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.860  -1.240   0.034  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.357  -1.866  -1.273  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.063  -3.368  -1.254  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.530  -1.948   1.215  1.00  0.00           C  
HETATM   19  O   UNL     1       8.625  -0.661   1.464  1.00  0.00           O  
HETATM   20  N   UNL     1       3.570  -0.194   0.234  1.00  0.00           N  
HETATM   21  C   UNL     1       3.885   0.927  -0.664  1.00  0.00           C  
HETATM   22  C   UNL     1       5.381   1.205  -0.587  1.00  0.00           C  
HETATM   23  C   UNL     1       6.191   0.001  -0.956  1.00  0.00           C  
HETATM   24  N   UNL     1       7.531   0.152  -0.352  1.00  0.00           N  
HETATM   25  C   UNL     1       8.585   1.027  -0.871  1.00  0.00           C  
HETATM   26  N   UNL     1      -2.067   0.361  -0.036  1.00  0.00           N  
HETATM   27  C   UNL     1      -4.279   1.347   0.039  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.214   0.225   0.058  1.00  0.00           C  
HETATM   29  N   UNL     1      -6.373   2.118   0.104  1.00  0.00           N  
HETATM   30  N   UNL     1      -4.450   3.696   0.063  1.00  0.00           N  
HETATM   31  N   UNL     1      -2.362   2.701  -0.003  1.00  0.00           N  
HETATM   32  C   UNL     1      -5.230  -3.448   1.138  1.00  0.00           C  
HETATM   33  O   UNL     1      -5.691  -3.961  -0.115  1.00  0.00           O  
HETATM   34  H   UNL     1       6.623  -2.464   1.183  1.00  0.00           H  
HETATM   35  H   UNL     1       5.770  -0.989   1.739  1.00  0.00           H  
HETATM   36  H   UNL     1       6.022  -2.133  -1.057  1.00  0.00           H  
HETATM   37  H   UNL     1       3.746  -1.652  -1.249  1.00  0.00           H  
HETATM   38  H   UNL     1       3.942  -2.239   0.412  1.00  0.00           H  
HETATM   39  H   UNL     1       1.913  -1.198   1.046  1.00  0.00           H  
HETATM   40  H   UNL     1       1.684   0.253  -1.630  1.00  0.00           H  
HETATM   41  H   UNL     1       1.895  -1.501  -1.415  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.489  -0.931  -1.785  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.239  -1.604  -0.157  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.413   1.364  -0.848  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.396   1.667   1.612  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.184  -0.087   1.828  1.00  0.00           H  
HETATM   47  H   UNL     1       1.989   1.097   1.983  1.00  0.00           H  
HETATM   48  H   UNL     1       1.739   1.770   0.354  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.674   4.746   0.028  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.366   0.178   0.122  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.779  -1.355   0.105  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.431  -1.706  -1.369  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.844  -1.404  -2.116  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.453  -3.826  -2.163  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.987  -3.528  -1.200  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.139  -1.546   2.150  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.608  -1.789   1.172  1.00  0.00           H  
HETATM   58  H   UNL     1       3.614   0.664  -1.687  1.00  0.00           H  
HETATM   59  H   UNL     1       3.332   1.813  -0.352  1.00  0.00           H  
HETATM   60  H   UNL     1       5.624   2.024  -1.264  1.00  0.00           H  
HETATM   61  H   UNL     1       5.633   1.502   0.431  1.00  0.00           H  
HETATM   62  H   UNL     1       6.278  -0.067  -2.040  1.00  0.00           H  
HETATM   63  H   UNL     1       9.465   0.955  -0.233  1.00  0.00           H  
HETATM   64  H   UNL     1       8.844   0.722  -1.885  1.00  0.00           H  
HETATM   65  H   UNL     1       8.228   2.057  -0.883  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.454  -0.525   0.045  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.135   2.717   0.131  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.155  -3.608   1.223  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.739  -3.963   1.953  1.00  0.00           H  
CONECT    1   19   19   24    2                                       
CONECT    2    1    3   34   35                                       
CONECT    3    4   23    2   36                                       
CONECT    4   20    3   37   38                                       
CONECT    5    6   10   20   39                                       
CONECT    6    7    5   40   41                                       
CONECT    7    8    6   42   43                                       
CONECT    8   26    7    9   44                                       
CONECT    9    8   10   45   46                                       
CONECT   10    9    5   47   48                                       
CONECT   11   27   26   31   31                                       
CONECT   12   30   30   31   49                                       
CONECT   13   29   27   27   30                                       
CONECT   14   28   28   29   50                                       
CONECT   15   18   16   28   51                                       
CONECT   16   17   15   52   53                                       
CONECT   17   33   16   54   55                                       
CONECT   18   32   15   56   57                                       
CONECT   19    1    1                                                 
CONECT   20    5   21    4                                            
CONECT   21   20   22   58   59                                       
CONECT   22   21   23   60   61                                       
CONECT   23   24   22    3   62                                       
CONECT   24   25    1   23                                            
CONECT   25   24   63   64   65                                       
CONECT   26   11    8   66                                            
CONECT   27   28   13   13   11                                       
CONECT   28   14   14   15   27                                       
CONECT   29   14   13   67                                            
CONECT   30   13   12   12                                            
CONECT   31   11   11   12                                            
CONECT   32   33   18   68   69                                       
CONECT   33   32   17                                                 
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   29                                                      
CONECT   68   32                                                      
CONECT   69   32                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
