COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.552  -2.505   0.423  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.367  -2.724   1.115  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.214  -2.072   0.735  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.238  -1.189  -0.349  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.432  -0.973  -1.042  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.579  -1.633  -0.658  1.00  0.00           C  
HETATM    7  O   UNL     1      -6.686  -3.151   0.800  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.009  -0.485  -0.755  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.779   0.851  -0.707  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.357   1.053  -1.240  1.00  0.00           C  
HETATM   11  C   UNL     1       0.583   0.523  -0.112  1.00  0.00           C  
HETATM   12  C   UNL     1       0.322  -1.006  -0.167  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.729  -1.113  -1.313  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.707   1.894  -0.237  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.198   2.850  -1.132  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.066   3.824  -0.688  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.454   3.857   0.645  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.968   2.910   1.538  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.104   1.929   1.102  1.00  0.00           C  
HETATM   20  O   UNL     1      -5.310   4.819   1.077  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.274  -0.042  -2.213  1.00  0.00           O  
HETATM   22  S   UNL     1       1.838  -1.907  -0.587  1.00  0.00           S  
HETATM   23  N   UNL     1       2.884  -1.554   0.647  1.00  0.00           N  
HETATM   24  C   UNL     1       3.813  -0.520   0.502  1.00  0.00           C  
HETATM   25  C   UNL     1       3.789   0.564   1.370  1.00  0.00           C  
HETATM   26  C   UNL     1       4.707   1.585   1.224  1.00  0.00           C  
HETATM   27  C   UNL     1       5.651   1.529   0.214  1.00  0.00           C  
HETATM   28  C   UNL     1       5.677   0.451  -0.654  1.00  0.00           C  
HETATM   29  C   UNL     1       4.765  -0.576  -0.508  1.00  0.00           C  
HETATM   30 CL   UNL     1       6.804   2.814   0.033  1.00  0.00          Cl  
HETATM   31  C   UNL     1       2.836  -2.326   1.892  1.00  0.00           C  
HETATM   32  C   UNL     1       3.866  -3.456   1.831  1.00  0.00           C  
HETATM   33  O   UNL     1       1.631  -3.309  -0.480  1.00  0.00           O  
HETATM   34  O   UNL     1       2.451  -1.343  -1.738  1.00  0.00           O  
HETATM   35  H   UNL     1      -4.350  -3.406   1.952  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.294  -2.242   1.274  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.455  -0.291  -1.880  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.502  -1.467  -1.194  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.211  -2.672   1.457  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.136   2.049  -1.622  1.00  0.00           H  
HETATM   41  H   UNL     1       1.625   0.749  -0.339  1.00  0.00           H  
HETATM   42  H   UNL     1       0.300   0.932   0.858  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.095  -1.364   0.774  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.844  -2.102  -1.756  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.897   2.825  -2.169  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.445   4.563  -1.379  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.272   2.940   2.573  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.731   1.190   1.796  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.243   4.571   1.016  1.00  0.00           H  
HETATM   50  H   UNL     1       3.052   0.608   2.159  1.00  0.00           H  
HETATM   51  H   UNL     1       4.689   2.428   1.899  1.00  0.00           H  
HETATM   52  H   UNL     1       6.414   0.410  -1.442  1.00  0.00           H  
HETATM   53  H   UNL     1       4.785  -1.417  -1.185  1.00  0.00           H  
HETATM   54  H   UNL     1       3.064  -1.672   2.734  1.00  0.00           H  
HETATM   55  H   UNL     1       1.840  -2.748   2.019  1.00  0.00           H  
HETATM   56  H   UNL     1       3.639  -4.109   0.989  1.00  0.00           H  
HETATM   57  H   UNL     1       4.863  -3.033   1.704  1.00  0.00           H  
HETATM   58  H   UNL     1       3.830  -4.030   2.757  1.00  0.00           H  
CONECT    1    6    6    2    7                                       
CONECT    2    3    3    1   35                                       
CONECT    3    4    2    2   36                                       
CONECT    4    8    5    5    3                                       
CONECT    5    4    4    6   37                                       
CONECT    6    5    1    1   38                                       
CONECT    7    1   39                                                 
CONECT    8   13    9    9    4                                       
CONECT    9   10   14    8    8                                       
CONECT   10   11   21    9   40                                       
CONECT   11   12   10   41   42                                       
CONECT   12   22   11   13   43                                       
CONECT   13   12   21    8   44                                       
CONECT   14    9   19   19   15                                       
CONECT   15   14   16   16   45                                       
CONECT   16   15   15   17   46                                       
CONECT   17   18   18   16   20                                       
CONECT   18   19   17   17   47                                       
CONECT   19   14   14   18   48                                       
CONECT   20   17   49                                                 
CONECT   21   10   13                                                 
CONECT   22   34   34   23   33                                       
CONECT   22   33   12                                                 
CONECT   23   24   22   31                                            
CONECT   24   29   29   25   23                                       
CONECT   25   26   26   24   50                                       
CONECT   26   27   25   25   51                                       
CONECT   27   30   28   28   26                                       
CONECT   28   27   27   29   52                                       
CONECT   29   28   24   24   53                                       
CONECT   30   27                                                      
CONECT   31   23   32   54   55                                       
CONECT   32   31   56   57   58                                       
CONECT   33   22   22                                                 
CONECT   34   22   22                                                 
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
