COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.516  -3.404   0.207  1.00  0.00           C  
HETATM    2  C   UNL     1       3.898  -2.283   0.715  1.00  0.00           C  
HETATM    3  C   UNL     1       2.580  -2.002   0.369  1.00  0.00           C  
HETATM    4  C   UNL     1       1.889  -2.878  -0.492  1.00  0.00           C  
HETATM    5  C   UNL     1       2.539  -4.011  -0.996  1.00  0.00           C  
HETATM    6  C   UNL     1       3.834  -4.262  -0.646  1.00  0.00           C  
HETATM    7  N   UNL     1       1.712  -0.991   0.709  1.00  0.00           N  
HETATM    8  C   UNL     1       0.504  -1.210   0.077  1.00  0.00           C  
HETATM    9  C   UNL     1       0.586  -2.350  -0.659  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.683  -0.348   0.183  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.813  -0.672  -0.475  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.028   0.122  -0.280  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.930  -0.008  -1.511  1.00  0.00           C  
HETATM   14  C   UNL     1       2.021   0.136   1.592  1.00  0.00           C  
HETATM   15  C   UNL     1       2.695   1.226   0.799  1.00  0.00           C  
HETATM   16  C   UNL     1       1.933   2.183   0.156  1.00  0.00           C  
HETATM   17  C   UNL     1       2.548   3.185  -0.573  1.00  0.00           C  
HETATM   18  C   UNL     1       3.926   3.231  -0.659  1.00  0.00           C  
HETATM   19  C   UNL     1       4.693   2.271  -0.015  1.00  0.00           C  
HETATM   20  C   UNL     1       4.073   1.264   0.710  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.245   0.730  -1.252  1.00  0.00           C  
HETATM   22  O   UNL     1       6.049   2.314  -0.098  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.644   0.658   0.866  1.00  0.00           O  
HETATM   24  C   UNL     1       6.377   3.446  -0.906  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.786  -0.394   0.948  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.108   0.365   1.078  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.936   0.125  -0.109  1.00  0.00           N  
HETATM   28  C   UNL     1      -7.179   0.886   0.083  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.089   0.690  -1.131  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.892   0.387   1.342  1.00  0.00           C  
HETATM   31  H   UNL     1       5.540  -3.617   0.474  1.00  0.00           H  
HETATM   32  H   UNL     1       4.437  -1.622   1.378  1.00  0.00           H  
HETATM   33  H   UNL     1       2.017  -4.685  -1.659  1.00  0.00           H  
HETATM   34  H   UNL     1       4.334  -5.137  -1.036  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.202  -2.776  -1.262  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.822  -1.431  -1.079  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.761   1.168  -0.132  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.431   0.429  -2.376  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.135  -1.062  -1.702  1.00  0.00           H  
HETATM   40  H   UNL     1       2.686  -0.198   2.389  1.00  0.00           H  
HETATM   41  H   UNL     1       1.098   0.520   2.027  1.00  0.00           H  
HETATM   42  H   UNL     1       0.856   2.149   0.222  1.00  0.00           H  
HETATM   43  H   UNL     1       1.951   3.932  -1.074  1.00  0.00           H  
HETATM   44  H   UNL     1       4.406   4.014  -1.227  1.00  0.00           H  
HETATM   45  H   UNL     1       4.668   0.515   1.213  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.036   1.778  -1.037  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.879   0.662  -2.136  1.00  0.00           H  
HETATM   48  H   UNL     1       5.989   4.351  -0.438  1.00  0.00           H  
HETATM   49  H   UNL     1       7.460   3.522  -1.002  1.00  0.00           H  
HETATM   50  H   UNL     1       5.932   3.328  -1.894  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.987  -1.459   0.831  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.184  -0.232   1.842  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.906   1.432   1.171  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.638   0.019   1.966  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.943   1.944   0.195  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.324  -0.368  -1.242  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.011   1.255  -0.988  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.580   1.046  -2.027  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.017  -0.694   1.284  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.298   0.638   2.220  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.870   0.862   1.417  1.00  0.00           H  
CONECT    1    2    2    6   31                                       
CONECT    2    1    1    3   32                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4    6    6   33                                       
CONECT    6    1    5    5   34                                       
CONECT    7    3    8   14                                            
CONECT    8    7    9    9   10                                       
CONECT    9    4    8    8   35                                       
CONECT   10    8   11   23   23                                       
CONECT   11   10   12   36                                            
CONECT   12   11   13   25   37                                       
CONECT   13   12   21   38   39                                       
CONECT   14    7   15   40   41                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   42                                       
CONECT   17   16   18   18   43                                       
CONECT   18   17   17   19   44                                       
CONECT   19   18   20   20   22                                       
CONECT   20   15   19   19   45                                       
CONECT   21   13   27   46   47                                       
CONECT   22   19   24                                                 
CONECT   23   10   10                                                 
CONECT   24   22   48   49   50                                       
CONECT   25   12   26   51   52                                       
CONECT   26   25   27   53   54                                       
CONECT   27   21   26   28                                            
CONECT   28   27   29   30   55                                       
CONECT   29   28   56   57   58                                       
CONECT   30   28   59   60   61                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
