COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.173  -0.621   1.282  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.412   0.219   0.982  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.305   1.567   1.706  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.632  -0.522   1.574  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.640   0.405  -0.436  1.00  0.00           N  
HETATM    6  O   UNL     1      -6.573  -0.583  -0.979  1.00  0.00           O  
HETATM    7  C   UNL     1      -4.528   0.654  -1.328  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.140   2.138  -1.329  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.971   0.297  -2.764  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.300  -0.193  -1.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.974  -0.103   0.489  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.804  -0.943   0.779  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.562  -0.441   0.633  1.00  0.00           C  
HETATM   14  S   UNL     1      -0.347   1.175   0.111  1.00  0.00           S  
HETATM   15  N   UNL     1       0.511  -1.212   0.899  1.00  0.00           N  
HETATM   16  C   UNL     1       1.801  -0.722   0.662  1.00  0.00           C  
HETATM   17  C   UNL     1       2.728  -1.502  -0.019  1.00  0.00           C  
HETATM   18  C   UNL     1       4.000  -1.014  -0.251  1.00  0.00           C  
HETATM   19 CL   UNL     1       2.289  -3.086  -0.576  1.00  0.00          Cl  
HETATM   20  C   UNL     1       2.155   0.547   1.102  1.00  0.00           C  
HETATM   21  C   UNL     1       3.428   1.028   0.866  1.00  0.00           C  
HETATM   22  C   UNL     1       4.350   0.248   0.193  1.00  0.00           C  
HETATM   23  S   UNL     1       5.973   0.866  -0.105  1.00  0.00           S  
HETATM   24  O   UNL     1       6.213   1.858   0.884  1.00  0.00           O  
HETATM   25  O   UNL     1       6.808  -0.270  -0.285  1.00  0.00           O  
HETATM   26  N   UNL     1       5.938   1.655  -1.560  1.00  0.00           N  
HETATM   27  H   UNL     1      -3.950  -0.571   2.350  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.365  -1.662   1.011  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.416   2.095   1.361  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.190   2.166   1.491  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.233   1.397   2.780  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.500  -0.636   2.650  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.537   0.053   1.377  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.718  -1.505   1.112  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.745  -0.483  -1.926  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.853   2.439  -0.321  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.302   2.295  -2.008  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.991   2.735  -1.657  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.823   0.916  -3.046  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.147   0.478  -3.455  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.256  -0.754  -2.806  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.496  -1.234  -1.268  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.447   0.165  -1.582  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.749   0.923   0.767  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.926  -1.859   1.075  1.00  0.00           H  
HETATM   46  H   UNL     1       0.390  -2.106   1.255  1.00  0.00           H  
HETATM   47  H   UNL     1       4.722  -1.619  -0.780  1.00  0.00           H  
HETATM   48  H   UNL     1       1.435   1.157   1.627  1.00  0.00           H  
HETATM   49  H   UNL     1       3.703   2.015   1.207  1.00  0.00           H  
HETATM   50  H   UNL     1       6.534   2.404  -1.721  1.00  0.00           H  
HETATM   51  H   UNL     1       5.321   1.370  -2.252  1.00  0.00           H  
CONECT    1    2   11   27   28                                       
CONECT    2    1    3    4    5                                       
CONECT    3    2   29   30   31                                       
CONECT    4    2   32   33   34                                       
CONECT    5    2    6    7                                            
CONECT    6    5   35                                                 
CONECT    7    5    8    9   10                                       
CONECT    8    7   36   37   38                                       
CONECT    9    7   39   40   41                                       
CONECT   10    7   11   42   43                                       
CONECT   11    1   10   12   44                                       
CONECT   12   11   13   45                                            
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   46                                            
CONECT   16   15   17   17   20                                       
CONECT   17   16   16   18   19                                       
CONECT   18   17   22   22   47                                       
CONECT   19   17                                                      
CONECT   20   16   21   21   48                                       
CONECT   21   20   20   22   49                                       
CONECT   22   18   18   21   23                                       
CONECT   23   22   24   24   25                                       
CONECT   23   25   26                                                 
CONECT   24   23   23                                                 
CONECT   25   23   23                                                 
CONECT   26   23   50   51                                            
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   15                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
