COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK     1      -8.455  -3.765   0.341  1.00  0.00           C  
HETATM    2  N   UNK     1      -8.905  -1.866  -1.107  1.00  0.00           N  
HETATM    3  O   UNK     1      -9.580  -3.630   0.760  1.00  0.00           O  
HETATM    4  N   UNK     1       4.042   2.400   1.023  1.00  0.00           N  
HETATM    5  C   UNK     1       3.197   3.410   1.116  1.00  0.00           C  
HETATM    6  N   UNK     1       1.905   3.272   0.903  1.00  0.00           N  
HETATM    7  C   UNK     1       1.394   2.089   0.580  1.00  0.00           C  
HETATM    8  C   UNK     1       2.253   0.982   0.467  1.00  0.00           C  
HETATM    9  C   UNK     1       3.624   1.179   0.704  1.00  0.00           C  
HETATM   10  N   UNK     1       4.517   0.127   0.608  1.00  0.00           N  
HETATM   11  N   UNK     1       1.488  -0.085   0.133  1.00  0.00           N  
HETATM   12  C   UNK     1       0.244   0.288   0.035  1.00  0.00           C  
HETATM   13  N   UNK     1       0.135   1.620   0.302  1.00  0.00           N  
HETATM   14  C   UNK     1      -7.841  -2.697  -0.528  1.00  0.00           C  
HETATM   15  C   UNK     1      -6.914  -1.823   0.318  1.00  0.00           C  
HETATM   16  C   UNK     1      -4.347   1.325  -0.810  1.00  0.00           C  
HETATM   17  S   UNK     1      -5.096   0.219   0.417  1.00  0.00           S  
HETATM   18  C   UNK     1      -6.196  -0.818  -0.586  1.00  0.00           C  
HETATM   19  C   UNK     1      -1.100   2.407   0.293  1.00  0.00           C  
HETATM   20  C   UNK     1      -1.296   3.101  -1.079  1.00  0.00           C  
HETATM   21  O   UNK     1      -0.613   4.356  -1.118  1.00  0.00           O  
HETATM   22  C   UNK     1       5.943   0.352   0.858  1.00  0.00           C  
HETATM   23  C   UNK     1       6.693  -0.945   0.690  1.00  0.00           C  
HETATM   24  C   UNK     1       7.202  -1.293  -0.547  1.00  0.00           C  
HETATM   25  C   UNK     1      -2.830   3.305  -1.123  1.00  0.00           C  
HETATM   26  O   UNK     1      -3.170   4.634  -0.722  1.00  0.00           O  
HETATM   27  C   UNK     1       7.891  -2.483  -0.702  1.00  0.00           C  
HETATM   28  C   UNK     1       8.070  -3.323   0.382  1.00  0.00           C  
HETATM   29  C   UNK     1       7.561  -2.974   1.619  1.00  0.00           C  
HETATM   30  C   UNK     1       6.878  -1.783   1.774  1.00  0.00           C  
HETATM   31 CL   UNK     1       8.530  -2.921  -2.255  1.00  0.00          Cl  
HETATM   32  C   UNK     1      -3.377   2.280  -0.111  1.00  0.00           C  
HETATM   33  O   UNK     1      -2.253   1.545   0.403  1.00  0.00           O  
HETATM   34  O   UNK     1      -7.750  -4.864   0.653  1.00  0.00           O  
HETATM   35  H   UNK     1      -9.493  -2.408  -1.722  1.00  0.00           H  
HETATM   36  H   UNK     1      -9.450  -1.421  -0.384  1.00  0.00           H  
HETATM   37  H   UNK     1       3.579   4.385   1.378  1.00  0.00           H  
HETATM   38  H   UNK     1       4.200  -0.760   0.375  1.00  0.00           H  
HETATM   39  H   UNK     1      -0.579  -0.363  -0.220  1.00  0.00           H  
HETATM   40  H   UNK     1      -7.269  -3.165  -1.329  1.00  0.00           H  
HETATM   41  H   UNK     1      -7.501  -1.286   1.063  1.00  0.00           H  
HETATM   42  H   UNK     1      -6.178  -2.452   0.819  1.00  0.00           H  
HETATM   43  H   UNK     1      -3.807   0.735  -1.549  1.00  0.00           H  
HETATM   44  H   UNK     1      -5.129   1.901  -1.305  1.00  0.00           H  
HETATM   45  H   UNK     1      -5.609  -1.355  -1.331  1.00  0.00           H  
HETATM   46  H   UNK     1      -6.931  -0.189  -1.087  1.00  0.00           H  
HETATM   47  H   UNK     1      -1.091   3.143   1.097  1.00  0.00           H  
HETATM   48  H   UNK     1      -0.966   2.455  -1.892  1.00  0.00           H  
HETATM   49  H   UNK     1      -0.706   4.828  -1.957  1.00  0.00           H  
HETATM   50  H   UNK     1       6.325   1.087   0.150  1.00  0.00           H  
HETATM   51  H   UNK     1       6.080   0.721   1.875  1.00  0.00           H  
HETATM   52  H   UNK     1       7.061  -0.636  -1.393  1.00  0.00           H  
HETATM   53  H   UNK     1      -3.214   3.100  -2.122  1.00  0.00           H  
HETATM   54  H   UNK     1      -2.801   5.323  -1.291  1.00  0.00           H  
HETATM   55  H   UNK     1       8.608  -4.252   0.262  1.00  0.00           H  
HETATM   56  H   UNK     1       7.701  -3.630   2.466  1.00  0.00           H  
HETATM   57  H   UNK     1       6.484  -1.508   2.741  1.00  0.00           H  
HETATM   58  H   UNK     1      -3.887   2.797   0.702  1.00  0.00           H  
HETATM   59  H   UNK     1      -8.185  -5.519   1.216  1.00  0.00           H  
CONECT    1    3    3   14   34                                       
CONECT    2   14   35   36                                            
CONECT    3    1    1                                                 
CONECT    4    5    5    9                                            
CONECT    5    4    4    6   37                                       
CONECT    6    5    7    7                                            
CONECT    7    6    6    8   13                                       
CONECT    8    7    9    9   11                                       
CONECT    9    4    8    8   10                                       
CONECT   10    9   22   38                                            
CONECT   11    8   12   12                                            
CONECT   12   11   11   13   39                                       
CONECT   13    7   12   19                                            
CONECT   14    1    2   15   40                                       
CONECT   15   14   18   41   42                                       
CONECT   16   17   32   43   44                                       
CONECT   17   16   18                                                 
CONECT   18   15   17   45   46                                       
CONECT   19   13   20   33   47                                       
CONECT   20   19   21   25   48                                       
CONECT   21   20   49                                                 
CONECT   22   10   23   50   51                                       
CONECT   23   22   24   24   30                                       
CONECT   24   23   23   27   52                                       
CONECT   25   20   26   32   53                                       
CONECT   26   25   54                                                 
CONECT   27   24   28   28   31                                       
CONECT   28   27   27   29   55                                       
CONECT   29   28   30   30   56                                       
CONECT   30   23   29   29   57                                       
CONECT   31   27                                                      
CONECT   32   16   25   33   58                                       
CONECT   33   19   32                                                 
CONECT   34    1   59                                                 
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38   10                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   32                                                      
CONECT   59   34                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
