COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.435   0.970   0.289  1.00  0.00           O  
HETATM    2 CL   UNL     1      -6.928  -2.467   1.370  1.00  0.00          Cl  
HETATM    3 CL   UNL     1       0.235  -3.730  -1.087  1.00  0.00          Cl  
HETATM    4  C   UNL     1      -7.907  -0.290   0.102  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.805   0.976  -0.438  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.794  -0.874   0.694  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.602   1.646  -0.383  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.592  -0.218   0.754  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.451   1.079   0.205  1.00  0.00           C  
HETATM   10  S   UNL     1      -6.047   3.238  -0.936  1.00  0.00           S  
HETATM   11  C   UNL     1      -4.352   3.143  -0.392  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.272   1.932   0.177  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.973   1.455   0.775  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.303   0.556  -0.167  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.116   0.004   0.157  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.427  -0.922  -0.812  1.00  0.00           C  
HETATM   17  C   UNL     1       1.412  -2.365  -1.128  1.00  0.00           C  
HETATM   18  N   UNL     1       0.910  -1.255  -0.303  1.00  0.00           N  
HETATM   19  C   UNL     1       2.758  -2.826  -0.565  1.00  0.00           C  
HETATM   20  C   UNL     1       1.771  -0.103  -0.592  1.00  0.00           C  
HETATM   21  N   UNL     1       3.642  -1.675  -0.395  1.00  0.00           N  
HETATM   22  C   UNL     1       3.215  -0.467  -0.403  1.00  0.00           C  
HETATM   23  N   UNL     1       4.123   0.545  -0.232  1.00  0.00           N  
HETATM   24  C   UNL     1       5.542   0.232  -0.046  1.00  0.00           C  
HETATM   25  C   UNL     1       6.333   1.531   0.122  1.00  0.00           C  
HETATM   26  C   UNL     1       8.733   1.778  -0.525  1.00  0.00           C  
HETATM   27  C   UNL     1       7.793   1.209   0.313  1.00  0.00           C  
HETATM   28  C   UNL     1      10.074   1.476  -0.340  1.00  0.00           C  
HETATM   29  N   UNL     1       8.159   0.392   1.282  1.00  0.00           N  
HETATM   30  C   UNL     1      10.419   0.609   0.686  1.00  0.00           C  
HETATM   31  C   UNL     1       9.424   0.078   1.483  1.00  0.00           C  
HETATM   32  O   UNL     1      -0.604   0.252   1.227  1.00  0.00           O  
HETATM   33  H   UNL     1       2.016   1.709   0.063  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.846  -0.824   0.065  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.664   1.440  -0.900  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.744  -0.697   1.220  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.574   3.885  -0.496  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.175   0.924   1.705  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.331   2.312   0.979  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.713   0.357  -1.023  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.334  -0.430  -1.781  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.012  -1.835  -0.922  1.00  0.00           H  
HETATM   43  H   UNL     1       1.543  -2.026  -2.156  1.00  0.00           H  
HETATM   44  H   UNL     1       3.215  -3.536  -1.254  1.00  0.00           H  
HETATM   45  H   UNL     1       2.601  -3.308   0.400  1.00  0.00           H  
HETATM   46  H   UNL     1       1.612   0.215  -1.623  1.00  0.00           H  
HETATM   47  H   UNL     1       3.826   1.469  -0.233  1.00  0.00           H  
HETATM   48  H   UNL     1       5.664  -0.385   0.844  1.00  0.00           H  
HETATM   49  H   UNL     1       5.912  -0.309  -0.917  1.00  0.00           H  
HETATM   50  H   UNL     1       6.211   2.148  -0.768  1.00  0.00           H  
HETATM   51  H   UNL     1       5.963   2.072   0.993  1.00  0.00           H  
HETATM   52  H   UNL     1       8.428   2.449  -1.314  1.00  0.00           H  
HETATM   53  H   UNL     1      10.831   1.905  -0.979  1.00  0.00           H  
HETATM   54  H   UNL     1      11.454   0.351   0.858  1.00  0.00           H  
HETATM   55  H   UNL     1       9.684  -0.598   2.284  1.00  0.00           H  
CONECT    1   20   33                                                 
CONECT    2    6                                                      
CONECT    3   17                                                      
CONECT    4    5    6    6   34                                       
CONECT    5    4    7    7   35                                       
CONECT    6    2    4    4    8                                       
CONECT    7    5    5    9   10                                       
CONECT    8    6    9    9   36                                       
CONECT    9    7    8    8   12                                       
CONECT   10    7   11                                                 
CONECT   11   10   12   12   37                                       
CONECT   12    9   11   11   13                                       
CONECT   13   12   14   38   39                                       
CONECT   14   13   15   40                                            
CONECT   15   14   16   32   32                                       
CONECT   16   15   18   41   42                                       
CONECT   17    3   18   19   43                                       
CONECT   18   16   17   20                                            
CONECT   19   17   21   44   45                                       
CONECT   20    1   18   22   46                                       
CONECT   21   19   22   22                                            
CONECT   22   20   21   21   23                                       
CONECT   23   22   24   47                                            
CONECT   24   23   25   48   49                                       
CONECT   25   24   27   50   51                                       
CONECT   26   27   28   28   52                                       
CONECT   27   25   26   29   29                                       
CONECT   28   26   26   30   53                                       
CONECT   29   27   27   31                                            
CONECT   30   28   31   31   54                                       
CONECT   31   29   30   30   55                                       
CONECT   32   15   15                                                 
CONECT   33    1                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   28                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
