COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.549   1.565  -0.048  1.00  0.00           C  
HETATM    2  C   UNL     1       3.908   0.967   0.112  1.00  0.00           C  
HETATM    3  C   UNL     1       4.183   2.314   0.382  1.00  0.00           C  
HETATM    4  C   UNL     1       3.140  -5.519   0.189  1.00  0.00           C  
HETATM    5  C   UNL     1       4.031  -1.755  -1.827  1.00  0.00           C  
HETATM    6 CL   UNL     1      -5.971  -1.533   0.049  1.00  0.00          Cl  
HETATM    7  C   UNL     1      -4.378  -0.954   0.426  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.912   0.224  -0.163  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.735   0.959  -1.075  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.388   1.543  -1.799  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.616   0.675   0.159  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.861  -0.082   1.054  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.401  -1.232   1.587  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.622  -1.627   1.270  1.00  0.00           N  
HETATM   15  N   UNL     1      -2.107   1.837  -0.399  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.767   2.184  -0.192  1.00  0.00           C  
HETATM   17  C   UNL     1       0.214   1.212  -0.255  1.00  0.00           C  
HETATM   18  C   UNL     1       2.619   0.559  -0.106  1.00  0.00           C  
HETATM   19  N   UNL     1       2.333  -0.764  -0.373  1.00  0.00           N  
HETATM   20  C   UNL     1       3.413  -1.751  -0.427  1.00  0.00           C  
HETATM   21  C   UNL     1       2.860  -3.118  -0.119  1.00  0.00           C  
HETATM   22  N   UNL     1       3.678  -4.190  -0.111  1.00  0.00           N  
HETATM   23  O   UNL     1       1.680  -3.255   0.122  1.00  0.00           O  
HETATM   24  O   UNL     1       5.339   2.656   0.573  1.00  0.00           O  
HETATM   25  N   UNL     1       3.211   3.240   0.437  1.00  0.00           N  
HETATM   26  C   UNL     1       1.887   2.901   0.228  1.00  0.00           C  
HETATM   27  C   UNL     1       0.887   3.865   0.288  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.426   3.509   0.077  1.00  0.00           C  
HETATM   29  H   UNL     1       4.714   0.250   0.074  1.00  0.00           H  
HETATM   30  H   UNL     1       2.376  -5.776  -0.545  1.00  0.00           H  
HETATM   31  H   UNL     1       3.944  -6.254   0.149  1.00  0.00           H  
HETATM   32  H   UNL     1       2.700  -5.517   1.186  1.00  0.00           H  
HETATM   33  H   UNL     1       4.431  -0.766  -2.050  1.00  0.00           H  
HETATM   34  H   UNL     1       4.835  -2.490  -1.867  1.00  0.00           H  
HETATM   35  H   UNL     1       3.267  -2.012  -2.561  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.863   0.229   1.326  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.817  -1.820   2.280  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.680   2.410  -0.933  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.050   0.185  -0.463  1.00  0.00           H  
HETATM   40  H   UNL     1       1.415  -1.040  -0.525  1.00  0.00           H  
HETATM   41  H   UNL     1       4.177  -1.494   0.306  1.00  0.00           H  
HETATM   42  H   UNL     1       4.622  -4.081  -0.304  1.00  0.00           H  
HETATM   43  H   UNL     1       3.442   4.162   0.627  1.00  0.00           H  
HETATM   44  H   UNL     1       1.140   4.894   0.500  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.200   4.262   0.123  1.00  0.00           H  
CONECT    1   17   18   26   26                                       
CONECT    2   18   18    3   29                                       
CONECT    3    2   25   24   24                                       
CONECT    4   22   30   31   32                                       
CONECT    5   20   33   34   35                                       
CONECT    6    7                                                      
CONECT    7    6   14   14    8                                       
CONECT    8    7    9   11   11                                       
CONECT    9    8   10   10   10                                       
CONECT   10    9    9    9                                            
CONECT   11    8    8   12   15                                       
CONECT   12   13   13   11   36                                       
CONECT   13   14   12   12   37                                       
CONECT   14    7    7   13                                            
CONECT   15   11   16   38                                            
CONECT   16   15   17   17   28                                       
CONECT   17   16   16    1   39                                       
CONECT   18   19    1    2    2                                       
CONECT   19   20   18   40                                            
CONECT   20    5   21   19   41                                       
CONECT   21   22   23   23   20                                       
CONECT   22    4   21   42                                            
CONECT   23   21   21                                                 
CONECT   24    3    3                                                 
CONECT   25   26    3   43                                            
CONECT   26    1    1   27   25                                       
CONECT   27   28   28   26   44                                       
CONECT   28   16   27   27   45                                       
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
CONECT   43   25                                                      
CONECT   44   27                                                      
CONECT   45   28                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
