COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.047  -1.254  -1.212  1.00  0.00           C  
HETATM    2  C   UNL     1       0.412  -2.713  -0.967  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.855  -3.336  -0.324  1.00  0.00           C  
HETATM    4  C   UNL     1       3.125   0.211  -0.044  1.00  0.00           C  
HETATM    5  C   UNL     1       3.418   1.150  -1.023  1.00  0.00           C  
HETATM    6  C   UNL     1       4.560   1.920  -0.920  1.00  0.00           C  
HETATM    7  C   UNL     1       5.411   1.756   0.157  1.00  0.00           C  
HETATM    8  C   UNL     1       5.122   0.821   1.133  1.00  0.00           C  
HETATM    9  C   UNL     1       3.981   0.048   1.035  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.921  -0.067  -0.402  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.030   1.167  -2.007  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.846   0.373   0.547  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.129   0.879   2.258  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.421  -2.177   0.523  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.892  -0.923  -0.044  1.00  0.00           N  
HETATM   16  C   UNL     1       1.162  -0.319  -1.276  1.00  0.00           C  
HETATM   17  O   UNL     1       2.000  -0.544  -0.140  1.00  0.00           O  
HETATM   18  N   UNL     1      -3.921   1.610  -1.148  1.00  0.00           N  
HETATM   19  N   UNL     1      -2.052   0.351  -1.658  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.872   1.240   0.135  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.040   0.165   1.896  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.616   1.508   1.224  1.00  0.00           N  
HETATM   23  C   UNL     1       3.666  -0.971   2.100  1.00  0.00           C  
HETATM   24  H   UNL     1      -0.628  -1.186  -2.131  1.00  0.00           H  
HETATM   25  H   UNL     1       0.656  -3.208  -1.907  1.00  0.00           H  
HETATM   26  H   UNL     1       1.256  -2.747  -0.279  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.568  -3.638  -1.091  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.589  -4.184   0.307  1.00  0.00           H  
HETATM   29  H   UNL     1       2.753   1.278  -1.865  1.00  0.00           H  
HETATM   30  H   UNL     1       4.788   2.651  -1.682  1.00  0.00           H  
HETATM   31  H   UNL     1       6.304   2.358   0.235  1.00  0.00           H  
HETATM   32  H   UNL     1       5.789   0.695   1.974  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.098   1.485  -3.037  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.537   0.922   3.257  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.510  -2.177   0.470  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.100  -2.284   1.559  1.00  0.00           H  
HETATM   37  H   UNL     1       1.725  -0.516  -2.188  1.00  0.00           H  
HETATM   38  H   UNL     1       0.821   0.716  -1.276  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.496  -0.390   2.477  1.00  0.00           H  
HETATM   40  H   UNL     1       4.117  -1.926   1.833  1.00  0.00           H  
HETATM   41  H   UNL     1       4.069  -0.634   3.056  1.00  0.00           H  
HETATM   42  H   UNL     1       2.586  -1.089   2.182  1.00  0.00           H  
CONECT    1    2   15   16   24                                       
CONECT    2    1    3   25   26                                       
CONECT    3    2   14   27   28                                       
CONECT    4   17    9    9    5                                       
CONECT    5    4    6    6   29                                       
CONECT    6    5    5    7   30                                       
CONECT    7    8    8    6   31                                       
CONECT    8    9    7    7   32                                       
CONECT    9   23    4    4    8                                       
CONECT   10   12   15   19   19                                       
CONECT   11   18   18   19   33                                       
CONECT   12   21   20   20   10                                       
CONECT   13   22   22   21   34                                       
CONECT   14   15    3   35   36                                       
CONECT   15   10    1   14                                            
CONECT   16    1   17   37   38                                       
CONECT   17   16    4                                                 
CONECT   18   20   11   11                                            
CONECT   19   10   10   11                                            
CONECT   20   22   12   12   18                                       
CONECT   21   13   12   39                                            
CONECT   22   13   13   20                                            
CONECT   23    9   40   41   42                                       
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   21                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
