COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.767  -3.031   1.491  1.00  0.00           C  
HETATM    2  C   UNL     1       0.359   3.651  -0.145  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.446   2.616  -0.605  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.684  -0.638   0.761  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.777   2.852  -0.888  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.650   1.729  -1.386  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.284   1.028  -0.212  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.008   0.045   1.106  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.929  -2.099   0.483  1.00  0.00           C  
HETATM   10  C   UNL     1       2.207   1.611   0.024  1.00  0.00           C  
HETATM   11  O   UNL     1       0.878   1.245   1.828  1.00  0.00           O  
HETATM   12  C   UNL     1       1.544   0.765   0.933  1.00  0.00           C  
HETATM   13  S   UNL     1       2.059   3.357   0.212  1.00  0.00           S  
HETATM   14  O   UNL     1      -4.109  -0.011  -0.416  1.00  0.00           O  
HETATM   15  C   UNL     1      -4.987  -4.371   1.234  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.368  -4.780  -0.030  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.530  -3.848  -1.038  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.316  -2.507  -0.780  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.052   1.402   0.913  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.309   4.116  -0.717  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.512   5.150  -0.260  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.180   4.923   0.027  1.00  0.00           C  
HETATM   23 CL   UNL     1       0.820   6.220   0.601  1.00  0.00          Cl  
HETATM   24  C   UNL     1       2.956   1.119  -0.982  1.00  0.00           C  
HETATM   25  O   UNL     1       3.577   1.971  -1.825  1.00  0.00           O  
HETATM   26  C   UNL     1       3.114  -0.365  -1.183  1.00  0.00           C  
HETATM   27  C   UNL     1       3.009  -1.078   0.168  1.00  0.00           C  
HETATM   28  C   UNL     1       1.656  -0.733   0.804  1.00  0.00           C  
HETATM   29  C   UNL     1       3.103  -2.568  -0.039  1.00  0.00           C  
HETATM   30  C   UNL     1       2.176  -3.216  -0.835  1.00  0.00           C  
HETATM   31 CL   UNL     1       0.899  -2.314  -1.590  1.00  0.00          Cl  
HETATM   32  C   UNL     1       2.266  -4.583  -1.029  1.00  0.00           C  
HETATM   33  C   UNL     1       3.283  -5.300  -0.428  1.00  0.00           C  
HETATM   34  C   UNL     1       4.210  -4.654   0.368  1.00  0.00           C  
HETATM   35  C   UNL     1       4.121  -3.287   0.562  1.00  0.00           C  
HETATM   36 CL   UNL     1       5.290  -2.473   1.555  1.00  0.00          Cl  
HETATM   37  H   UNL     1      -4.465  -2.712   2.477  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.031   1.628  -0.740  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.994  -0.538   1.599  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.429   2.133  -2.032  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.044   1.019  -1.948  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.831   1.102   1.307  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.698  -0.054   0.268  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.440  -0.425   1.990  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.860  -5.099   2.022  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.536  -5.827  -0.231  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.828  -4.167  -2.026  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.443  -1.778  -1.568  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.350   4.297  -0.940  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.931   6.136  -0.127  1.00  0.00           H  
HETATM   51  H   UNL     1       3.487   2.902  -1.579  1.00  0.00           H  
HETATM   52  H   UNL     1       2.330  -0.729  -1.847  1.00  0.00           H  
HETATM   53  H   UNL     1       4.089  -0.568  -1.627  1.00  0.00           H  
HETATM   54  H   UNL     1       3.818  -0.746   0.819  1.00  0.00           H  
HETATM   55  H   UNL     1       1.591  -1.186   1.793  1.00  0.00           H  
HETATM   56  H   UNL     1       0.850  -1.111   0.174  1.00  0.00           H  
HETATM   57  H   UNL     1       1.542  -5.089  -1.650  1.00  0.00           H  
HETATM   58  H   UNL     1       3.353  -6.367  -0.579  1.00  0.00           H  
HETATM   59  H   UNL     1       5.004  -5.215   0.838  1.00  0.00           H  
CONECT    1   15   15    9   37                                       
CONECT    2   13    3    3   22                                       
CONECT    3    2    2    5   38                                       
CONECT    4    9    8   14   39                                       
CONECT    5    3    6   20   20                                       
CONECT    6    7    5   40   41                                       
CONECT    7   14   19   19    6                                       
CONECT    8    4   42   43   44                                       
CONECT    9   18   18    1    4                                       
CONECT   10   24   24   12   13                                       
CONECT   11   12   12                                                 
CONECT   12   28   10   11   11                                       
CONECT   13   10    2                                                 
CONECT   14    4    7                                                 
CONECT   15   16    1    1   45                                       
CONECT   16   17   17   15   46                                       
CONECT   17   16   16   18   47                                       
CONECT   18   17    9    9   48                                       
CONECT   19    7    7                                                 
CONECT   20    5    5   21   49                                       
CONECT   21   22   22   20   50                                       
CONECT   22    2   23   21   21                                       
CONECT   23   22                                                      
CONECT   24   26   25   10   10                                       
CONECT   25   24   51                                                 
CONECT   26   27   24   52   53                                       
CONECT   27   26   29   28   54                                       
CONECT   28   27   12   55   56                                       
CONECT   29   30   30   35   27                                       
CONECT   30   31   32   29   29                                       
CONECT   31   30                                                      
CONECT   32   33   33   30   57                                       
CONECT   33   32   32   34   58                                       
CONECT   34   33   35   35   59                                       
CONECT   35   34   34   29   36                                       
CONECT   36   35                                                      
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   32                                                      
CONECT   58   33                                                      
CONECT   59   34                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
