COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       1.093   0.094  -1.565  1.00  0.00           S  
HETATM    2  O   UNL     1       2.062  -0.862  -1.157  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.995   0.345   0.742  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.744   1.178   1.206  1.00  0.00           O  
HETATM    5  C   UNL     1      -1.418   0.581  -0.623  1.00  0.00           C  
HETATM    6  N   UNL     1      -0.327  -0.375  -0.857  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.770  -1.773   1.083  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.547  -1.767  -0.430  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.718  -0.737   1.469  1.00  0.00           N  
HETATM   10  O   UNL     1       1.184   1.496  -1.356  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.417  -0.896   2.747  1.00  0.00           C  
HETATM   12  C   UNL     1       2.519   0.093   8.767  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.194  -0.576   6.387  1.00  0.00           N  
HETATM   14  C   UNL     1       0.548  -0.008   7.417  1.00  0.00           C  
HETATM   15  C   UNL     1       1.814  -0.497   7.739  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.457   0.167   6.318  1.00  0.00           C  
HETATM   17  C   UNL     1       0.049   1.067   8.151  1.00  0.00           C  
HETATM   18  C   UNL     1       0.536  -0.309   5.143  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.602  -0.232   3.859  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.330  -0.397   5.197  1.00  0.00           C  
HETATM   21  N   UNL     1       2.009   1.106   9.442  1.00  0.00           N  
HETATM   22  C   UNL     1       0.815   1.597   9.168  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.227  -0.901   3.957  1.00  0.00           C  
HETATM   24  C   UNL     1       0.430   0.905  -4.059  1.00  0.00           C  
HETATM   25  C   UNL     1       0.912  -0.120  -3.304  1.00  0.00           C  
HETATM   26  C   UNL     1       0.642  -0.499  -6.039  1.00  0.00           C  
HETATM   27  C   UNL     1       1.136  -1.534  -5.227  1.00  0.00           C  
HETATM   28  C   UNL     1       1.263  -1.336  -3.886  1.00  0.00           C  
HETATM   29  C   UNL     1       0.284   0.737  -5.447  1.00  0.00           C  
HETATM   30 CL   UNL     1      -0.165   0.147  -9.896  1.00  0.00          Cl  
HETATM   31  C   UNL     1      -0.209   1.773  -6.259  1.00  0.00           C  
HETATM   32  C   UNL     1       0.490  -0.669  -7.425  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.337   1.575  -7.599  1.00  0.00           C  
HETATM   34  C   UNL     1       0.013   0.358  -8.182  1.00  0.00           C  
HETATM   35  H   UNL     1      -1.034   1.600  -0.685  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.192   0.435  -1.376  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.159  -2.746   1.384  1.00  0.00           H  
HETATM   38  H   UNL     1       0.179  -1.596   1.586  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.426  -2.172  -0.933  1.00  0.00           H  
HETATM   40  H   UNL     1       0.326  -2.370  -0.675  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.398  -0.426   2.686  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.535  -1.957   2.967  1.00  0.00           H  
HETATM   43  H   UNL     1       3.500  -0.278   9.023  1.00  0.00           H  
HETATM   44  H   UNL     1       2.237  -1.326   7.191  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.248   1.219   6.121  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.983   0.076   7.269  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.926   1.473   7.932  1.00  0.00           H  
HETATM   48  H   UNL     1       0.640   0.766   5.007  1.00  0.00           H  
HETATM   49  H   UNL     1       1.525  -0.764   5.200  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.479   0.827   3.639  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.277   0.143   5.165  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.520  -1.454   5.380  1.00  0.00           H  
HETATM   53  H   UNL     1       0.434   2.427   9.745  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.353  -1.973   4.103  1.00  0.00           H  
HETATM   55  H   UNL     1       0.330  -0.721   3.038  1.00  0.00           H  
HETATM   56  H   UNL     1       0.162   1.842  -3.594  1.00  0.00           H  
HETATM   57  H   UNL     1       1.412  -2.482  -5.664  1.00  0.00           H  
HETATM   58  H   UNL     1       1.643  -2.133  -3.264  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.485   2.721  -5.821  1.00  0.00           H  
HETATM   60  H   UNL     1       0.755  -1.607  -7.890  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.717   2.373  -8.220  1.00  0.00           H  
CONECT    1    2    2    6   10                                       
CONECT    1   10   25                                                 
CONECT    2    1    1                                                 
CONECT    3    4    4    5    9                                       
CONECT    4    3    3                                                 
CONECT    5    3    6   35   36                                       
CONECT    6    1    5    8                                            
CONECT    7    8    9   37   38                                       
CONECT    8    6    7   39   40                                       
CONECT    9    3    7   11                                            
CONECT   10    1    1                                                 
CONECT   11    9   19   41   42                                       
CONECT   12   15   15   21   43                                       
CONECT   13   14   16   18                                            
CONECT   14   13   15   17   17                                       
CONECT   15   12   12   14   44                                       
CONECT   16   13   20   45   46                                       
CONECT   17   14   14   22   47                                       
CONECT   18   13   23   48   49                                       
CONECT   19   11   20   23   50                                       
CONECT   20   16   19   51   52                                       
CONECT   21   12   22   22                                            
CONECT   22   17   21   21   53                                       
CONECT   23   18   19   54   55                                       
CONECT   24   25   29   29   56                                       
CONECT   25    1   24   28   28                                       
CONECT   26   27   27   29   32                                       
CONECT   27   26   26   28   57                                       
CONECT   28   25   25   27   58                                       
CONECT   29   24   24   26   31                                       
CONECT   30   34                                                      
CONECT   31   29   33   33   59                                       
CONECT   32   26   34   34   60                                       
CONECT   33   31   31   34   61                                       
CONECT   34   30   32   32   33                                       
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
