COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       0.133   4.401   0.164  1.00  0.00          Cl  
HETATM    2  C   UNL     1       1.541   3.390   0.057  1.00  0.00           C  
HETATM    3  C   UNL     1       2.793   3.962  -0.086  1.00  0.00           C  
HETATM    4  C   UNL     1       3.919   3.162  -0.172  1.00  0.00           C  
HETATM    5  C   UNL     1       3.799   1.788  -0.115  1.00  0.00           C  
HETATM    6  C   UNL     1       1.410   2.016   0.121  1.00  0.00           C  
HETATM    7  C   UNL     1       2.540   1.206   0.029  1.00  0.00           C  
HETATM    8  C   UNL     1       2.406  -0.269   0.097  1.00  0.00           C  
HETATM    9  N   UNL     1       3.487  -1.041   0.009  1.00  0.00           N  
HETATM   10  N   UNL     1       1.207  -0.822   0.251  1.00  0.00           N  
HETATM   11  C   UNL     1       1.093  -2.144   0.317  1.00  0.00           C  
HETATM   12  N   UNL     1       2.178  -2.909   0.228  1.00  0.00           N  
HETATM   13  C   UNL     1       3.368  -2.356   0.069  1.00  0.00           C  
HETATM   14  C   UNL     1       4.594  -3.227  -0.032  1.00  0.00           C  
HETATM   15  C   UNL     1       4.847  -3.584  -1.497  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.150  -2.723   0.483  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.300  -1.929   0.459  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.391  -0.862  -0.426  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.529  -0.080  -0.447  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.577  -0.357   0.411  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.490  -1.418   1.293  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.357  -2.209   1.316  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.817   0.499   0.385  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.803  -0.075  -0.600  1.00  0.00           C  
HETATM   25  O   UNL     1      -5.526  -1.079  -1.220  1.00  0.00           O  
HETATM   26  N   UNL     1      -6.992   0.529  -0.792  1.00  0.00           N  
HETATM   27  H   UNL     1       2.892   5.036  -0.131  1.00  0.00           H  
HETATM   28  H   UNL     1       4.893   3.613  -0.283  1.00  0.00           H  
HETATM   29  H   UNL     1       4.678   1.165  -0.183  1.00  0.00           H  
HETATM   30  H   UNL     1       0.432   1.571   0.233  1.00  0.00           H  
HETATM   31  H   UNL     1       5.455  -2.689   0.365  1.00  0.00           H  
HETATM   32  H   UNL     1       4.439  -4.140   0.544  1.00  0.00           H  
HETATM   33  H   UNL     1       3.986  -4.122  -1.894  1.00  0.00           H  
HETATM   34  H   UNL     1       5.001  -2.671  -2.072  1.00  0.00           H  
HETATM   35  H   UNL     1       5.733  -4.214  -1.570  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.225  -3.681   0.617  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.573  -0.645  -1.097  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.600   0.750  -1.135  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.312  -1.635   1.959  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.290  -3.037   2.005  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.266   0.519   1.378  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.552   1.513   0.086  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.214   1.333  -0.297  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.627   0.160  -1.426  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    6    1    3    3                                       
CONECT    3    2    2    4   27                                       
CONECT    4    5    5    3   28                                       
CONECT    5    7    4    4   29                                       
CONECT    6    7    7    2   30                                       
CONECT    7    8    6    6    5                                       
CONECT    8   10   10    9    7                                       
CONECT    9   13   13    8                                            
CONECT   10   11    8    8                                            
CONECT   11   16   12   12   10                                       
CONECT   12   11   11   13                                            
CONECT   13   12   14    9    9                                       
CONECT   14   13   15   31   32                                       
CONECT   15   14   33   34   35                                       
CONECT   16   17   11   36                                            
CONECT   17   22   16   18   18                                       
CONECT   18   17   17   19   37                                       
CONECT   19   20   20   18   38                                       
CONECT   20   23   21   19   19                                       
CONECT   21   22   22   20   39                                       
CONECT   22   21   21   17   40                                       
CONECT   23   20   24   41   42                                       
CONECT   24   23   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   43   44                                            
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31   14                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
