COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.962  -2.810   1.168  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.036  -1.376   0.711  1.00  0.00           C  
HETATM    3  N   UNL     1      -7.107  -0.631   0.672  1.00  0.00           N  
HETATM    4  N   UNL     1      -6.805   0.539   0.231  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.528   0.593  -0.032  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.775   1.785  -0.567  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.356   2.187  -1.924  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.909   2.953   0.412  1.00  0.00           C  
HETATM    9  N   UNL     1      -5.002  -0.619   0.270  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.602  -1.030   0.139  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.170  -0.906  -1.325  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.664  -1.196  -1.426  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.378  -2.490  -0.630  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.103  -2.014   0.812  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.248  -0.476   0.756  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.724  -0.133   1.015  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.958  -0.133  -0.662  1.00  0.00           N  
HETATM   18  C   UNL     1       0.486  -0.166  -0.927  1.00  0.00           C  
HETATM   19  C   UNL     1       1.143   1.081  -0.331  1.00  0.00           C  
HETATM   20  C   UNL     1       2.647   1.047  -0.607  1.00  0.00           C  
HETATM   21  N   UNL     1       3.248  -0.085   0.103  1.00  0.00           N  
HETATM   22  C   UNL     1       4.396  -0.630  -0.347  1.00  0.00           C  
HETATM   23  O   UNL     1       4.931  -0.183  -1.339  1.00  0.00           O  
HETATM   24  C   UNL     1       5.015  -1.794   0.383  1.00  0.00           C  
HETATM   25  C   UNL     1       4.093  -3.036   0.302  1.00  0.00           C  
HETATM   26  C   UNL     1       5.081  -4.209   0.524  1.00  0.00           C  
HETATM   27  C   UNL     1       6.357  -3.776  -0.227  1.00  0.00           C  
HETATM   28  C   UNL     1       6.315  -2.241  -0.316  1.00  0.00           C  
HETATM   29  C   UNL     1       3.275   2.330  -0.128  1.00  0.00           C  
HETATM   30  C   UNL     1       3.598   3.365  -0.906  1.00  0.00           C  
HETATM   31  C   UNL     1       4.164   4.440  -0.242  1.00  0.00           C  
HETATM   32  C   UNL     1       4.301   4.278   1.075  1.00  0.00           C  
HETATM   33  S   UNL     1       3.687   2.697   1.542  1.00  0.00           S  
HETATM   34  H   UNL     1      -6.036  -3.470   0.304  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.013  -2.981   1.676  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.784  -3.016   1.854  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.723   1.527  -0.683  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.812   3.049  -2.310  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.261   1.355  -2.621  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.409   2.444  -1.807  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.495   2.666   1.379  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.365   3.815   0.025  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.962   3.211   0.529  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.497  -2.066   0.460  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.722  -1.624  -1.931  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.372   0.105  -1.681  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.326  -1.255  -2.461  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.246  -3.149  -0.653  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.503  -2.999  -1.035  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.836  -2.440   1.498  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.094  -2.291   1.116  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.580   0.026   1.456  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.905   0.912   0.765  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.959  -0.305   2.065  1.00  0.00           H  
HETATM   55  H   UNL     1       0.919  -1.057  -0.473  1.00  0.00           H  
HETATM   56  H   UNL     1       0.658  -0.187  -2.003  1.00  0.00           H  
HETATM   57  H   UNL     1       0.710   1.972  -0.785  1.00  0.00           H  
HETATM   58  H   UNL     1       0.971   1.102   0.745  1.00  0.00           H  
HETATM   59  H   UNL     1       2.818   0.936  -1.678  1.00  0.00           H  
HETATM   60  H   UNL     1       2.820  -0.442   0.897  1.00  0.00           H  
HETATM   61  H   UNL     1       5.212  -1.530   1.422  1.00  0.00           H  
HETATM   62  H   UNL     1       3.340  -3.011   1.089  1.00  0.00           H  
HETATM   63  H   UNL     1       3.625  -3.106  -0.680  1.00  0.00           H  
HETATM   64  H   UNL     1       5.288  -4.338   1.586  1.00  0.00           H  
HETATM   65  H   UNL     1       4.680  -5.130   0.100  1.00  0.00           H  
HETATM   66  H   UNL     1       7.241  -4.094   0.326  1.00  0.00           H  
HETATM   67  H   UNL     1       6.366  -4.209  -1.227  1.00  0.00           H  
HETATM   68  H   UNL     1       6.304  -1.927  -1.360  1.00  0.00           H  
HETATM   69  H   UNL     1       7.179  -1.813   0.193  1.00  0.00           H  
HETATM   70  H   UNL     1       3.430   3.365  -1.973  1.00  0.00           H  
HETATM   71  H   UNL     1       4.471   5.341  -0.751  1.00  0.00           H  
HETATM   72  H   UNL     1       4.721   5.007   1.752  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    9    3    3    1                                       
CONECT    3    4    2    2                                            
CONECT    4    5    5    3                                            
CONECT    5    6    4    4    9                                       
CONECT    6    7    8    5   37                                       
CONECT    7    6   38   39   40                                       
CONECT    8    6   41   42   43                                       
CONECT    9    5   10    2                                            
CONECT   10   11    9   16   44                                       
CONECT   11   12   10   45   46                                       
CONECT   12   11   17   13   47                                       
CONECT   13   12   14   48   49                                       
CONECT   14   13   15   50   51                                       
CONECT   15   17   16   14   52                                       
CONECT   16   10   15   53   54                                       
CONECT   17   12   18   15                                            
CONECT   18   19   17   55   56                                       
CONECT   19   20   18   57   58                                       
CONECT   20   29   19   21   59                                       
CONECT   21   20   22   60                                            
CONECT   22   21   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   28   25   61                                       
CONECT   25   24   26   62   63                                       
CONECT   26   25   27   64   65                                       
CONECT   27   28   26   66   67                                       
CONECT   28   24   27   68   69                                       
CONECT   29   30   30   33   20                                       
CONECT   30   31   29   29   70                                       
CONECT   31   32   32   30   71                                       
CONECT   32   31   31   33   72                                       
CONECT   33   32   29                                                 
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   25                                                      
CONECT   64   26                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   28                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
CONECT   72   32                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
