COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.065  -1.447  -0.318  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.132  -1.016   0.996  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.088  -0.296   1.542  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.969  -0.003   0.771  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.908  -0.432  -0.549  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.952  -1.156  -1.088  1.00  0.00           C  
HETATM    7 CL   UNL     1      -7.379  -2.352  -1.001  1.00  0.00          Cl  
HETATM    8  S   UNL     1      -2.635   0.916   1.464  1.00  0.00           S  
HETATM    9  C   UNL     1      -1.519   0.976   0.036  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.271   1.737   0.406  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.148   2.194   1.522  1.00  0.00           O  
HETATM   12  N   UNL     1       0.707   1.910  -0.505  1.00  0.00           N  
HETATM   13  C   UNL     1       1.920   2.650  -0.146  1.00  0.00           C  
HETATM   14  C   UNL     1       3.075   2.201  -1.043  1.00  0.00           C  
HETATM   15  C   UNL     1       3.394   0.754  -0.765  1.00  0.00           C  
HETATM   16  C   UNL     1       2.756  -0.242  -1.481  1.00  0.00           C  
HETATM   17  C   UNL     1       3.046  -1.569  -1.229  1.00  0.00           C  
HETATM   18  C   UNL     1       3.979  -1.901  -0.256  1.00  0.00           C  
HETATM   19  C   UNL     1       4.614  -0.898   0.465  1.00  0.00           C  
HETATM   20  C   UNL     1       4.323   0.427   0.205  1.00  0.00           C  
HETATM   21  N   UNL     1       4.274  -3.244   0.002  1.00  0.00           N  
HETATM   22  C   UNL     1       5.546  -3.608   0.381  1.00  0.00           C  
HETATM   23  N   UNL     1       6.502  -2.722   0.394  1.00  0.00           N  
HETATM   24  N   UNL     1       5.809  -4.908   0.746  1.00  0.00           N  
HETATM   25  C   UNL     1       1.682   4.126  -0.334  1.00  0.00           C  
HETATM   26  O   UNL     1       0.605   4.521  -0.729  1.00  0.00           O  
HETATM   27  N   UNL     1       2.665   5.007  -0.063  1.00  0.00           N  
HETATM   28  H   UNL     1      -7.001  -1.245   1.594  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.140   0.038   2.567  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.040  -0.205  -1.151  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.903  -1.494  -2.113  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.017   1.476  -0.794  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.251  -0.039  -0.259  1.00  0.00           H  
HETATM   34  H   UNL     1       0.608   1.545  -1.398  1.00  0.00           H  
HETATM   35  H   UNL     1       2.170   2.452   0.896  1.00  0.00           H  
HETATM   36  H   UNL     1       3.954   2.813  -0.837  1.00  0.00           H  
HETATM   37  H   UNL     1       2.789   2.316  -2.088  1.00  0.00           H  
HETATM   38  H   UNL     1       2.031   0.017  -2.238  1.00  0.00           H  
HETATM   39  H   UNL     1       2.547  -2.347  -1.789  1.00  0.00           H  
HETATM   40  H   UNL     1       5.340  -1.154   1.223  1.00  0.00           H  
HETATM   41  H   UNL     1       4.819   1.207   0.762  1.00  0.00           H  
HETATM   42  H   UNL     1       3.583  -3.919  -0.086  1.00  0.00           H  
HETATM   43  H   UNL     1       7.398  -2.978   0.661  1.00  0.00           H  
HETATM   44  H   UNL     1       5.084  -5.547   0.822  1.00  0.00           H  
HETATM   45  H   UNL     1       6.721  -5.186   0.924  1.00  0.00           H  
HETATM   46  H   UNL     1       3.526   4.691   0.253  1.00  0.00           H  
HETATM   47  H   UNL     1       2.512   5.957  -0.184  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2    4    4   29                                       
CONECT    4    3    3    5    8                                       
CONECT    5    4    6    6   30                                       
CONECT    6    1    5    5   31                                       
CONECT    7    1                                                      
CONECT    8    4    9                                                 
CONECT    9    8   10   32   33                                       
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   34                                            
CONECT   13   12   14   25   35                                       
CONECT   14   13   15   36   37                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   38                                       
CONECT   17   16   18   18   39                                       
CONECT   18   17   17   19   21                                       
CONECT   19   18   20   20   40                                       
CONECT   20   15   19   19   41                                       
CONECT   21   18   22   42                                            
CONECT   22   21   23   23   24                                       
CONECT   23   22   22   43                                            
CONECT   24   22   44   45                                            
CONECT   25   13   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   25   46   47                                            
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
