COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.674  -4.809  -1.235  1.00  0.00           C  
HETATM    2  C   UNL     1       6.332  -4.013   0.026  1.00  0.00           C  
HETATM    3  C   UNL     1       6.127  -2.542  -0.339  1.00  0.00           C  
HETATM    4  C   UNL     1       5.784  -1.746   0.922  1.00  0.00           C  
HETATM    5  N   UNL     1       5.588  -0.337   0.572  1.00  0.00           N  
HETATM    6  C   UNL     1       6.633   0.511   0.587  1.00  0.00           C  
HETATM    7  O   UNL     1       7.733   0.091   0.892  1.00  0.00           O  
HETATM    8  N   UNL     1       6.492   1.810   0.272  1.00  0.00           N  
HETATM    9  C   UNL     1       5.290   2.315  -0.073  1.00  0.00           C  
HETATM   10  O   UNL     1       5.174   3.494  -0.357  1.00  0.00           O  
HETATM   11  C   UNL     1       4.166   1.461  -0.101  1.00  0.00           C  
HETATM   12  N   UNL     1       2.828   1.629  -0.397  1.00  0.00           N  
HETATM   13  C   UNL     1       2.175   2.876  -0.800  1.00  0.00           C  
HETATM   14  C   UNL     1       2.215   3.004  -2.325  1.00  0.00           C  
HETATM   15  C   UNL     1       4.327   0.119   0.222  1.00  0.00           C  
HETATM   16  N   UNL     1       3.129  -0.461   0.112  1.00  0.00           N  
HETATM   17  C   UNL     1       2.237   0.428  -0.245  1.00  0.00           C  
HETATM   18  C   UNL     1       0.774   0.146  -0.468  1.00  0.00           C  
HETATM   19  S   UNL     1      -0.130   0.376   1.088  1.00  0.00           S  
HETATM   20  C   UNL     1      -1.794   0.009   0.637  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.201  -0.345  -0.580  1.00  0.00           N  
HETATM   22  N   UNL     1      -2.828   0.037   1.454  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.955  -0.316   0.701  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.272  -0.450   1.005  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.763  -0.195   2.407  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.514  -0.548  -0.572  1.00  0.00           C  
HETATM   27  N   UNL     1      -4.377  -0.907  -1.529  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.657  -1.044  -1.267  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.608  -1.450  -2.363  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.141  -0.816   0.026  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.609  -0.972   0.330  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.341   0.327  -0.012  1.00  0.00           C  
HETATM   33  C   UNL     1      -9.831   0.168   0.296  1.00  0.00           C  
HETATM   34  C   UNL     1     -10.564   1.467  -0.045  1.00  0.00           C  
HETATM   35  H   UNL     1       7.589  -4.413  -1.677  1.00  0.00           H  
HETATM   36  H   UNL     1       6.820  -5.857  -0.975  1.00  0.00           H  
HETATM   37  H   UNL     1       5.858  -4.723  -1.952  1.00  0.00           H  
HETATM   38  H   UNL     1       5.417  -4.409   0.468  1.00  0.00           H  
HETATM   39  H   UNL     1       7.148  -4.099   0.743  1.00  0.00           H  
HETATM   40  H   UNL     1       7.041  -2.146  -0.781  1.00  0.00           H  
HETATM   41  H   UNL     1       5.310  -2.456  -1.056  1.00  0.00           H  
HETATM   42  H   UNL     1       4.869  -2.142   1.364  1.00  0.00           H  
HETATM   43  H   UNL     1       6.600  -1.832   1.639  1.00  0.00           H  
HETATM   44  H   UNL     1       7.267   2.393   0.292  1.00  0.00           H  
HETATM   45  H   UNL     1       1.138   2.869  -0.464  1.00  0.00           H  
HETATM   46  H   UNL     1       2.696   3.722  -0.351  1.00  0.00           H  
HETATM   47  H   UNL     1       3.252   3.011  -2.661  1.00  0.00           H  
HETATM   48  H   UNL     1       1.694   2.158  -2.774  1.00  0.00           H  
HETATM   49  H   UNL     1       1.729   3.932  -2.625  1.00  0.00           H  
HETATM   50  H   UNL     1       0.383   0.831  -1.220  1.00  0.00           H  
HETATM   51  H   UNL     1       0.650  -0.881  -0.812  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.922   0.086   3.040  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.494   0.613   2.394  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.227  -1.099   2.799  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.055  -1.584  -3.293  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.096  -2.387  -2.092  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.361  -0.674  -2.496  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.018  -1.788  -0.267  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.739  -1.196   1.388  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.932   1.142   0.585  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.211   0.550  -1.070  1.00  0.00           H  
HETATM   62  H   UNL     1     -10.241  -0.647  -0.300  1.00  0.00           H  
HETATM   63  H   UNL     1      -9.962  -0.055   1.355  1.00  0.00           H  
HETATM   64  H   UNL     1     -11.625   1.354   0.175  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.154   2.283   0.552  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.433   1.691  -1.104  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    1    3   38   39                                       
CONECT    3    2    4   40   41                                       
CONECT    4    3    5   42   43                                       
CONECT    5    4   15    6                                            
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9   44                                            
CONECT    9   11    8   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   15   15   12    9                                       
CONECT   12   17   11   13                                            
CONECT   13   12   14   45   46                                       
CONECT   14   13   47   48   49                                       
CONECT   15   16    5   11   11                                       
CONECT   16   17   17   15                                            
CONECT   17   18   16   16   12                                       
CONECT   18   19   17   50   51                                       
CONECT   19   20   18                                                 
CONECT   20   22   22   21   19                                       
CONECT   21   26   26   20                                            
CONECT   22   23   20   20                                            
CONECT   23   24   26   22                                            
CONECT   24   30   30   25   23                                       
CONECT   25   24   52   53   54                                       
CONECT   26   27   23   21   21                                       
CONECT   27   28   28   26                                            
CONECT   28   29   30   27   27                                       
CONECT   29   28   55   56   57                                       
CONECT   30   31   28   24   24                                       
CONECT   31   32   30   58   59                                       
CONECT   32   33   31   60   61                                       
CONECT   33   34   32   62   63                                       
CONECT   34   33   64   65   66                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    4                                                      
CONECT   44    8                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
