COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.972   0.563  -4.353  1.00  0.00           C  
HETATM    2  C   UNL     1       0.640  -0.415  -3.522  1.00  0.00           C  
HETATM    3  C   UNL     1       1.085   1.441  -6.680  1.00  0.00           C  
HETATM    4  S   UNL     1       0.921  -0.235  -1.792  1.00  0.00           S  
HETATM    5  C   UNL     1       0.737   0.413  -5.804  1.00  0.00           C  
HETATM    6 CL   UNL     1       0.021  -0.046 -10.228  1.00  0.00          Cl  
HETATM    7  O   UNL     1       1.656  -1.386  -1.399  1.00  0.00           O  
HETATM    8  C   UNL     1      -1.952   0.738   0.598  1.00  0.00           C  
HETATM    9  O   UNL     1      -2.475   1.725   1.072  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.380   0.825  -0.786  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.547  -0.359  -1.037  1.00  0.00           N  
HETATM   12  C   UNL     1       0.166  -0.758  -6.303  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.239  -1.603   0.934  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.068  -1.660  -0.584  1.00  0.00           C  
HETATM   15  C   UNL     1       0.863   1.295  -8.034  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.910  -0.373   1.333  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.055  -0.891  -7.658  1.00  0.00           C  
HETATM   18  C   UNL     1       0.297   0.130  -8.524  1.00  0.00           C  
HETATM   19  O   UNL     1       1.339   1.109  -1.606  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.586  -0.357   2.633  1.00  0.00           C  
HETATM   21  C   UNL     1       2.630  -0.489   8.494  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.238  -0.531   6.202  1.00  0.00           N  
HETATM   23  C   UNL     1       0.648  -0.143   7.202  1.00  0.00           C  
HETATM   24  C   UNL     1       1.776  -0.908   7.495  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.296   0.483   6.159  1.00  0.00           C  
HETATM   26  C   UNL     1       0.433   1.024   7.935  1.00  0.00           C  
HETATM   27  C   UNL     1       0.495  -0.450   4.934  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.606   0.108   3.711  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.311   0.126   5.071  1.00  0.00           C  
HETATM   30  N   UNL     1       2.388   0.619   9.169  1.00  0.00           N  
HETATM   31  C   UNL     1       1.331   1.370   8.922  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.420  -0.858   3.779  1.00  0.00           C  
HETATM   33  H   UNL     1       1.414   1.470  -3.969  1.00  0.00           H  
HETATM   34  H   UNL     1       0.198  -1.322  -3.906  1.00  0.00           H  
HETATM   35  H   UNL     1       1.527   2.350  -6.300  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.773   1.727  -0.874  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.190   0.856  -1.514  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.104  -1.557  -5.630  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.832  -2.457   1.261  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.258  -1.646   1.408  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.032  -1.854  -1.056  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.364  -2.450  -0.846  1.00  0.00           H  
HETATM   43  H   UNL     1       1.133   2.090  -8.713  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.497  -1.797  -8.046  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.434   0.326   2.592  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.939  -1.360   2.871  1.00  0.00           H  
HETATM   47  H   UNL     1       3.506  -1.075   8.727  1.00  0.00           H  
HETATM   48  H   UNL     1       1.979  -1.816   6.947  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.857   1.456   5.940  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.799   0.522   7.125  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.429   1.643   7.738  1.00  0.00           H  
HETATM   52  H   UNL     1       0.840   0.572   4.780  1.00  0.00           H  
HETATM   53  H   UNL     1       1.354  -1.120   4.969  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.249   1.110   3.472  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.108   0.870   5.059  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.733  -0.857   5.275  1.00  0.00           H  
HETATM   57  H   UNL     1       1.171   2.270   9.497  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.785  -1.871   3.944  1.00  0.00           H  
HETATM   59  H   UNL     1       0.135  -0.818   2.842  1.00  0.00           H  
CONECT    1    2    2    5   33                                       
CONECT    2    1    1    4   34                                       
CONECT    3    5    5   15   35                                       
CONECT    4    2    7    7   11                                       
CONECT    4   19   19                                                 
CONECT    5    1    3    3   12                                       
CONECT    6   18                                                      
CONECT    7    4    4                                                 
CONECT    8    9    9   10   16                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   36   37                                       
CONECT   11    4   10   14                                            
CONECT   12    5   17   17   38                                       
CONECT   13   14   16   39   40                                       
CONECT   14   11   13   41   42                                       
CONECT   15    3   18   18   43                                       
CONECT   16    8   13   20                                            
CONECT   17   12   12   18   44                                       
CONECT   18    6   15   15   17                                       
CONECT   19    4    4                                                 
CONECT   20   16   28   45   46                                       
CONECT   21   24   24   30   47                                       
CONECT   22   23   25   27                                            
CONECT   23   22   24   26   26                                       
CONECT   24   21   21   23   48                                       
CONECT   25   22   29   49   50                                       
CONECT   26   23   23   31   51                                       
CONECT   27   22   32   52   53                                       
CONECT   28   20   29   32   54                                       
CONECT   29   25   28   55   56                                       
CONECT   30   21   31   31                                            
CONECT   31   26   30   30   57                                       
CONECT   32   27   28   58   59                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
