COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.605   0.272  -0.418  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.492  -0.343   0.755  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.103  -0.145   0.522  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.942  -2.975  -0.024  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.448  -0.343   0.277  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.214   0.297  -0.900  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.806   1.791  -0.810  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.333   1.686  -0.343  1.00  0.00           C  
HETATM    9  C   UNL     1       5.125  -2.991   0.516  1.00  0.00           C  
HETATM   10  N   UNL     1       5.853   1.421   0.187  1.00  0.00           N  
HETATM   11  C   UNL     1       6.074   0.140  -0.118  1.00  0.00           C  
HETATM   12  C   UNL     1       5.032  -0.689  -0.402  1.00  0.00           C  
HETATM   13  C   UNL     1       4.649   1.925   0.223  1.00  0.00           C  
HETATM   14  C   UNL     1       4.463   3.379   0.572  1.00  0.00           C  
HETATM   15  C   UNL     1       5.271  -2.137  -0.745  1.00  0.00           C  
HETATM   16  N   UNL     1       3.564   1.161  -0.050  1.00  0.00           N  
HETATM   17  C   UNL     1       3.727  -0.162  -0.368  1.00  0.00           C  
HETATM   18  N   UNL     1       2.523  -0.670  -0.584  1.00  0.00           N  
HETATM   19  N   UNL     1       2.186   1.403  -0.092  1.00  0.00           N  
HETATM   20  C   UNL     1       0.120   0.076  -0.583  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.977  -0.540   0.589  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.586  -1.688   0.251  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.963  -1.412   0.213  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.895   0.379   0.749  1.00  0.00           N  
HETATM   25  N   UNL     1      -5.315   0.544   0.596  1.00  0.00           N  
HETATM   26  H   UNL     1      -0.037  -1.277   1.086  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.309   0.434   1.497  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.860  -3.545   0.901  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.540  -3.534  -0.744  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.947  -2.803  -0.434  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.105  -0.431   1.143  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.079  -1.328  -0.009  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.893  -0.134  -1.848  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.290   0.179  -0.769  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.874   2.273  -1.786  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.413   2.318  -0.073  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.679   1.490  -1.192  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.031   2.601   0.166  1.00  0.00           H  
HETATM   39  H   UNL     1       5.853  -2.669   1.260  1.00  0.00           H  
HETATM   40  H   UNL     1       4.119  -2.874   0.919  1.00  0.00           H  
HETATM   41  H   UNL     1       5.297  -4.038   0.268  1.00  0.00           H  
HETATM   42  H   UNL     1       7.084  -0.240  -0.138  1.00  0.00           H  
HETATM   43  H   UNL     1       5.436   3.835   0.758  1.00  0.00           H  
HETATM   44  H   UNL     1       3.974   3.892  -0.257  1.00  0.00           H  
HETATM   45  H   UNL     1       3.846   3.462   1.466  1.00  0.00           H  
HETATM   46  H   UNL     1       6.277  -2.254  -1.148  1.00  0.00           H  
HETATM   47  H   UNL     1       4.543  -2.459  -1.489  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.336   1.010  -0.914  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.064  -0.701  -1.326  1.00  0.00           H  
CONECT    1   20   18   19   19                                       
CONECT    2   21   20   26   27                                       
CONECT    3   25   23   23   24                                       
CONECT    4   22   28   29   30                                       
CONECT    5    6   25   31   32                                       
CONECT    6    7    5   33   34                                       
CONECT    7    6    8   35   36                                       
CONECT    8    7   25   37   38                                       
CONECT    9   15   39   40   41                                       
CONECT   10   13   13   11                                            
CONECT   11   12   12   10   42                                       
CONECT   12   17   15   11   11                                       
CONECT   13   16   14   10   10                                       
CONECT   14   13   43   44   45                                       
CONECT   15    9   12   46   47                                       
CONECT   16   19   17   13                                            
CONECT   17   18   18   16   12                                       
CONECT   18    1   17   17                                            
CONECT   19    1    1   16                                            
CONECT   20    2    1   48   49                                       
CONECT   21   24   24   22    2                                       
CONECT   22   23   21    4                                            
CONECT   23    3    3   22                                            
CONECT   24    3   21   21                                            
CONECT   25    8    5    3                                            
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
