COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -5.368  -1.350  -1.163  1.00  0.00          Cl  
HETATM    2  C   UNL     1       1.549  -0.315   0.109  1.00  0.00           C  
HETATM    3  C   UNL     1       2.545  -1.301   0.186  1.00  0.00           C  
HETATM    4  C   UNL     1       3.878  -0.931   0.020  1.00  0.00           C  
HETATM    5  C   UNL     1       4.166   0.403  -0.215  1.00  0.00           C  
HETATM    6  C   UNL     1       3.123   1.331  -0.279  1.00  0.00           C  
HETATM    7  N   UNL     1       1.869   0.956  -0.119  1.00  0.00           N  
HETATM    8  C   UNL     1       0.271  -1.017   0.318  1.00  0.00           C  
HETATM    9  C   UNL     1       0.570  -2.330   0.499  1.00  0.00           C  
HETATM   10  N   UNL     1       1.921  -2.507   0.428  1.00  0.00           N  
HETATM   11  C   UNL     1      -3.286  -0.029   0.018  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.738   1.059   0.725  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.398   0.800   0.898  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.076  -0.411   0.328  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.187  -0.962  -0.223  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.410   1.053   0.112  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.801   2.093   0.797  1.00  0.00           C  
HETATM   18  N   UNL     1      -3.516   2.072   1.083  1.00  0.00           N  
HETATM   19  C   UNL     1      -4.650  -0.030  -0.293  1.00  0.00           C  
HETATM   20  C   UNL     1       2.608  -3.792   0.577  1.00  0.00           C  
HETATM   21  O   UNL     1       3.405   2.639  -0.509  1.00  0.00           O  
HETATM   22  C   UNL     1       2.298   3.541  -0.564  1.00  0.00           C  
HETATM   23  O   UNL     1       5.454   0.807  -0.382  1.00  0.00           O  
HETATM   24  C   UNL     1       6.465  -0.199  -0.303  1.00  0.00           C  
HETATM   25  H   UNL     1       4.668  -1.666   0.074  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.151  -3.114   0.678  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.772   1.385   1.354  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.248  -1.908  -0.741  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.466   1.092  -0.112  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.397   2.937   1.111  1.00  0.00           H  
HETATM   31  H   UNL     1       2.860  -3.950   1.626  1.00  0.00           H  
HETATM   32  H   UNL     1       1.955  -4.595   0.236  1.00  0.00           H  
HETATM   33  H   UNL     1       3.520  -3.788  -0.019  1.00  0.00           H  
HETATM   34  H   UNL     1       1.624   3.241  -1.366  1.00  0.00           H  
HETATM   35  H   UNL     1       1.765   3.520   0.386  1.00  0.00           H  
HETATM   36  H   UNL     1       2.662   4.551  -0.754  1.00  0.00           H  
HETATM   37  H   UNL     1       7.444   0.256  -0.453  1.00  0.00           H  
HETATM   38  H   UNL     1       6.432  -0.672   0.679  1.00  0.00           H  
HETATM   39  H   UNL     1       6.292  -0.950  -1.074  1.00  0.00           H  
CONECT    1   19                                                      
CONECT    2    3    3    7    8                                       
CONECT    3    2    2    4   10                                       
CONECT    4    3    5    5   25                                       
CONECT    5    4    4    6   23                                       
CONECT    6    5    7    7   21                                       
CONECT    7    2    6    6                                            
CONECT    8    2    9    9   14                                       
CONECT    9    8    8   10   26                                       
CONECT   10    3    9   20                                            
CONECT   11   12   12   15   19                                       
CONECT   12   11   11   13   18                                       
CONECT   13   12   14   27                                            
CONECT   14    8   13   15   15                                       
CONECT   15   11   14   14   28                                       
CONECT   16   17   19   19   29                                       
CONECT   17   16   18   18   30                                       
CONECT   18   12   17   17                                            
CONECT   19    1   11   16   16                                       
CONECT   20   10   31   32   33                                       
CONECT   21    6   22                                                 
CONECT   22   21   34   35   36                                       
CONECT   23    5   24                                                 
CONECT   24   23   37   38   39                                       
CONECT   25    4                                                      
CONECT   26    9                                                      
CONECT   27   13                                                      
CONECT   28   15                                                      
CONECT   29   16                                                      
CONECT   30   17                                                      
CONECT   31   20                                                      
CONECT   32   20                                                      
CONECT   33   20                                                      
CONECT   34   22                                                      
CONECT   35   22                                                      
CONECT   36   22                                                      
CONECT   37   24                                                      
CONECT   38   24                                                      
CONECT   39   24                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
