COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.026   1.221   0.160  1.00  0.00           C  
HETATM    2  C   UNL     1       1.615   0.218  -0.128  1.00  0.00           C  
HETATM    3  C   UNL     1       1.794   0.891  -1.490  1.00  0.00           C  
HETATM    4  C   UNL     1       3.180   1.478  -1.581  1.00  0.00           C  
HETATM    5  C   UNL     1       4.193   0.764  -2.194  1.00  0.00           C  
HETATM    6  C   UNL     1       5.464   1.302  -2.277  1.00  0.00           C  
HETATM    7  C   UNL     1       5.721   2.553  -1.749  1.00  0.00           C  
HETATM    8  C   UNL     1       4.708   3.266  -1.136  1.00  0.00           C  
HETATM    9  C   UNL     1       3.435   2.731  -1.058  1.00  0.00           C  
HETATM   10  C   UNL     1       2.539  -0.969  -0.029  1.00  0.00           C  
HETATM   11  C   UNL     1       4.713  -1.951   0.465  1.00  0.00           C  
HETATM   12  C   UNL     1       6.072  -1.492   0.928  1.00  0.00           C  
HETATM   13  C   UNL     1       6.372  -1.443   2.277  1.00  0.00           C  
HETATM   14  N   UNL     1       7.558  -1.042   2.689  1.00  0.00           N  
HETATM   15  C   UNL     1      -6.920  -1.395  -0.604  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.764  -2.278  -1.080  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.385  -3.262   0.028  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.196  -3.054  -2.326  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.113  -0.692  -0.406  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.499   0.922   0.445  1.00  0.00           C  
HETATM   21  C   UNL     1       8.500  -0.676   1.842  1.00  0.00           C  
HETATM   22  C   UNL     1       8.273  -0.700   0.479  1.00  0.00           C  
HETATM   23  C   UNL     1       7.039  -1.121   0.007  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.277   2.236   0.538  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.701   1.950   0.939  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.658   1.713  -0.029  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.964   1.450   0.339  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.313   1.425   1.676  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.356   1.661   2.645  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.049   1.918   2.277  1.00  0.00           C  
HETATM   31  N   UNL     1      -3.050   0.103  -0.637  1.00  0.00           N  
HETATM   32  N   UNL     1       3.815  -0.798   0.369  1.00  0.00           N  
HETATM   33  O   UNL     1      -4.619  -1.445  -1.401  1.00  0.00           O  
HETATM   34  O   UNL     1      -4.614  -0.730   0.700  1.00  0.00           O  
HETATM   35  O   UNL     1       2.134  -2.078  -0.306  1.00  0.00           O  
HETATM   36  S   UNL     1      -0.103  -0.337   0.051  1.00  0.00           S  
HETATM   37  H   UNL     1      -0.940   1.760  -0.783  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.616   1.830   0.965  1.00  0.00           H  
HETATM   39  H   UNL     1       1.851   0.929   0.664  1.00  0.00           H  
HETATM   40  H   UNL     1       1.659   0.154  -2.280  1.00  0.00           H  
HETATM   41  H   UNL     1       1.056   1.685  -1.602  1.00  0.00           H  
HETATM   42  H   UNL     1       3.992  -0.213  -2.606  1.00  0.00           H  
HETATM   43  H   UNL     1       6.255   0.744  -2.756  1.00  0.00           H  
HETATM   44  H   UNL     1       6.714   2.973  -1.814  1.00  0.00           H  
HETATM   45  H   UNL     1       4.908   4.246  -0.727  1.00  0.00           H  
HETATM   46  H   UNL     1       2.644   3.289  -0.580  1.00  0.00           H  
HETATM   47  H   UNL     1       4.803  -2.424  -0.513  1.00  0.00           H  
HETATM   48  H   UNL     1       4.309  -2.668   1.180  1.00  0.00           H  
HETATM   49  H   UNL     1       5.626  -1.735   3.000  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.190  -0.693  -1.393  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.779  -2.020  -0.363  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.612  -0.842   0.284  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.245  -3.888   0.269  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.562  -3.891  -0.312  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.077  -2.710   0.915  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.466  -2.352  -3.116  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.373  -3.683  -2.665  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.056  -3.679  -2.085  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.584   0.383   1.389  1.00  0.00           H  
HETATM   60  H   UNL     1       9.459  -0.349   2.217  1.00  0.00           H  
HETATM   61  H   UNL     1       9.048  -0.398  -0.210  1.00  0.00           H  
HETATM   62  H   UNL     1       6.833  -1.150  -1.053  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.812   2.882   1.282  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.266   2.734  -0.432  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.385   1.733  -1.074  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.712   1.266  -0.418  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.334   1.220   1.964  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.628   1.641   3.690  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.300   2.099   3.034  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.649   0.134  -1.520  1.00  0.00           H  
HETATM   71  H   UNL     1       4.139   0.089   0.591  1.00  0.00           H  
CONECT    1   20   36   37   38                                       
CONECT    2   36   10    3   39                                       
CONECT    3    2    4   40   41                                       
CONECT    4    9    3    5    5                                       
CONECT    5    4    4    6   42                                       
CONECT    6    7    7    5   43                                       
CONECT    7    8    6    6   44                                       
CONECT    8    9    9    7   45                                       
CONECT    9    8    8    4   46                                       
CONECT   10   32    2   35   35                                       
CONECT   11   12   32   47   48                                       
CONECT   12   23   23   13   11                                       
CONECT   13   14   14   12   49                                       
CONECT   14   21   13   13                                            
CONECT   15   16   50   51   52                                       
CONECT   16   18   15   33   17                                       
CONECT   17   16   53   54   55                                       
CONECT   18   16   56   57   58                                       
CONECT   19   33   31   34   34                                       
CONECT   20   31   24    1   59                                       
CONECT   21   22   22   14   60                                       
CONECT   22   21   21   23   61                                       
CONECT   23   22   12   12   62                                       
CONECT   24   25   20   63   64                                       
CONECT   25   26   24   30   30                                       
CONECT   26   27   27   25   65                                       
CONECT   27   26   26   28   66                                       
CONECT   28   27   29   29   67                                       
CONECT   29   28   28   30   68                                       
CONECT   30   25   25   29   69                                       
CONECT   31   19   20   70                                            
CONECT   32   11   10   71                                            
CONECT   33   16   19                                                 
CONECT   34   19   19                                                 
CONECT   35   10   10                                                 
CONECT   36    1    2                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   30                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
