COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.806  -1.934   1.547  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.504  -0.634   1.900  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.151   2.091  -0.480  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.074   0.930  -0.526  1.00  0.00           C  
HETATM    5  C   UNL     1       1.148   0.779   0.111  1.00  0.00           C  
HETATM    6  C   UNL     1       2.237   0.273  -0.593  1.00  0.00           C  
HETATM    7  C   UNL     1       2.093  -0.079  -1.934  1.00  0.00           C  
HETATM    8  C   UNL     1       0.873   0.075  -2.561  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.210   0.572  -1.861  1.00  0.00           C  
HETATM   10  C   UNL     1       3.549   0.109   0.082  1.00  0.00           C  
HETATM   11  C   UNL     1       3.747   0.426   1.377  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.114   3.905   0.909  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.382   2.546   0.260  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.549   2.671  -0.721  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.024   0.251   0.943  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.851  -0.175  -0.368  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.155  -1.477  -0.715  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.627  -2.358   0.242  1.00  0.00           C  
HETATM   19  C   UNL     1       5.762  -0.461   0.223  1.00  0.00           C  
HETATM   20  C   UNL     1       4.669  -0.390  -0.566  1.00  0.00           C  
HETATM   21  C   UNL     1       7.085  -0.948  -0.199  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.718   1.567   1.297  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.172   1.439   0.178  1.00  0.00           N  
HETATM   24  N   UNL     1       8.130  -0.974   0.701  1.00  0.00           N  
HETATM   25  N   UNL     1       7.269  -1.356  -1.426  1.00  0.00           N  
HETATM   26  O   UNL     1      -2.040   2.312  -1.667  1.00  0.00           O  
HETATM   27  S   UNL     1       5.359   0.110   1.836  1.00  0.00           S  
HETATM   28 CL   UNL     1      -5.008  -3.993  -0.199  1.00  0.00          Cl  
HETATM   29  H   UNL     1      -5.178  -2.623   2.291  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.640  -0.305   2.920  1.00  0.00           H  
HETATM   31  H   UNL     1       1.255   1.053   1.150  1.00  0.00           H  
HETATM   32  H   UNL     1       2.937  -0.472  -2.483  1.00  0.00           H  
HETATM   33  H   UNL     1       0.763  -0.199  -3.600  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.163   0.690  -2.356  1.00  0.00           H  
HETATM   35  H   UNL     1       2.989   0.827   2.034  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.950   4.653   0.133  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.971   4.194   1.517  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.228   3.838   1.541  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.802   1.686  -1.113  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.414   3.089  -0.205  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.264   3.327  -1.543  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.479   0.511  -1.114  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.021  -1.808  -1.735  1.00  0.00           H  
HETATM   44  H   UNL     1       4.668  -0.692  -1.603  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.728   1.833   2.230  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.228   1.321   1.139  1.00  0.00           H  
HETATM   47  H   UNL     1       7.994  -0.670   1.613  1.00  0.00           H  
HETATM   48  H   UNL     1       8.141  -1.678  -1.704  1.00  0.00           H  
HETATM   49  H   UNL     1       9.002  -1.295   0.423  1.00  0.00           H  
CONECT    1    2    2   18   29                                       
CONECT    2   15    1    1   30                                       
CONECT    3   23   26   26   13                                       
CONECT    4    5    5    9   23                                       
CONECT    5    6    4    4   31                                       
CONECT    6   10    7    7    5                                       
CONECT    7    6    6    8   32                                       
CONECT    8    7    9    9   33                                       
CONECT    9    8    8    4   34                                       
CONECT   10   11   11   20    6                                       
CONECT   11   27   10   10   35                                       
CONECT   12   13   36   37   38                                       
CONECT   13    3   12   22   14                                       
CONECT   14   13   39   40   41                                       
CONECT   15   22   16   16    2                                       
CONECT   16   15   15   17   42                                       
CONECT   17   16   18   18   43                                       
CONECT   18   17   17    1   28                                       
CONECT   19   27   21   20   20                                       
CONECT   20   19   19   10   44                                       
CONECT   21   25   25   19   24                                       
CONECT   22   13   15   45                                            
CONECT   23    4    3   46                                            
CONECT   24   21   47   49                                            
CONECT   25   21   21   48                                            
CONECT   26    3    3                                                 
CONECT   27   11   19                                                 
CONECT   28   18                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   24                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
