COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.236   1.729  -0.432  1.00  0.00           C  
HETATM    2  C   UNL     1       3.235  -2.203   1.249  1.00  0.00           C  
HETATM    3  C   UNL     1       2.081  -0.054   0.694  1.00  0.00           C  
HETATM    4  C   UNL     1       3.232  -0.817   0.657  1.00  0.00           C  
HETATM    5  C   UNL     1       4.378  -0.315   0.069  1.00  0.00           C  
HETATM    6  C   UNL     1       5.637   1.506  -1.099  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.805   3.790   0.218  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.099  -3.035  -0.275  1.00  0.00           C  
HETATM    9  C   UNL     1       2.080   1.224   0.148  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.800   0.160  -0.058  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.646  -0.563  -0.088  1.00  0.00           N  
HETATM   12  N   UNL     1      -0.407   0.079  -0.005  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.330   1.387   0.103  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.492   2.172   0.138  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.729   1.569   0.058  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.832  -0.678  -0.147  1.00  0.00           N  
HETATM   17  C   UNL     1      -3.390  -1.921  -0.239  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.003  -1.888  -0.205  1.00  0.00           C  
HETATM   19  N   UNL     1       0.918   1.999   0.184  1.00  0.00           N  
HETATM   20  C   UNL     1       4.382   0.959  -0.470  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.891   2.333   0.097  1.00  0.00           N  
HETATM   22  N   UNL     1       0.197  -2.893   0.068  1.00  0.00           N  
HETATM   23  O   UNL     1      -1.516  -4.117  -0.643  1.00  0.00           O  
HETATM   24  H   UNL     1       3.238   2.722  -0.857  1.00  0.00           H  
HETATM   25  H   UNL     1       2.732  -2.890   0.568  1.00  0.00           H  
HETATM   26  H   UNL     1       4.263  -2.531   1.402  1.00  0.00           H  
HETATM   27  H   UNL     1       2.711  -2.191   2.205  1.00  0.00           H  
HETATM   28  H   UNL     1       1.184  -0.450   1.145  1.00  0.00           H  
HETATM   29  H   UNL     1       5.274  -0.917   0.035  1.00  0.00           H  
HETATM   30  H   UNL     1       5.651   1.254  -2.160  1.00  0.00           H  
HETATM   31  H   UNL     1       5.659   2.589  -0.983  1.00  0.00           H  
HETATM   32  H   UNL     1       6.508   1.070  -0.611  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.252   4.193  -0.631  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.809   4.214   0.232  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.289   4.048   1.142  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.418   3.246   0.227  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.002  -2.806  -0.324  1.00  0.00           H  
HETATM   38  H   UNL     1       0.980   2.963   0.265  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.757   1.901   0.044  1.00  0.00           H  
HETATM   40  H   UNL     1       0.818  -3.625  -0.071  1.00  0.00           H  
HETATM   41  H   UNL     1       0.509  -2.059   0.453  1.00  0.00           H  
CONECT    1   20    9    9   24                                       
CONECT    2    4   25   26   27                                       
CONECT    3    4    4    9   28                                       
CONECT    4    5    2    3    3                                       
CONECT    5   20   20    4   29                                       
CONECT    6   20   30   31   32                                       
CONECT    7   21   33   34   35                                       
CONECT    8   22   23   23   18                                       
CONECT    9    1    1    3   19                                       
CONECT   10   11   15   16   16                                       
CONECT   11   12   18   10                                            
CONECT   12   13   13   11                                            
CONECT   13   19   12   12   14                                       
CONECT   14   13   15   15   36                                       
CONECT   15   14   14   10   21                                       
CONECT   16   10   10   17                                            
CONECT   17   18   18   16   37                                       
CONECT   18    8   11   17   17                                       
CONECT   19    9   13   38                                            
CONECT   20    6    5    5    1                                       
CONECT   21   15    7   39                                            
CONECT   22    8   40   41                                            
CONECT   23    8    8                                                 
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36   14                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
