COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.780  -1.155  -0.136  1.00  0.00           N  
HETATM    2  C   UNL     1       4.205  -1.402  -1.477  1.00  0.00           C  
HETATM    3  C   UNL     1       3.620  -2.826  -1.462  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.702  -0.494  -0.775  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.505   0.637  -0.647  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.848  -0.180  -1.093  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.270  -0.903   0.188  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.216  -2.077  -0.143  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.252  -2.091   1.000  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.844  -0.925   1.926  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.145   2.170  -0.541  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.016   2.843  -0.270  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.917   1.876  -0.329  1.00  0.00           C  
HETATM   14  C   UNL     1       3.871  -3.352  -0.030  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.538   1.966  -0.145  1.00  0.00           C  
HETATM   16  C   UNL     1       5.448   1.136  -0.686  1.00  0.00           C  
HETATM   17  C   UNL     1       6.924   0.741  -0.592  1.00  0.00           C  
HETATM   18  C   UNL     1       7.412   0.930   0.845  1.00  0.00           C  
HETATM   19  C   UNL     1       6.587   0.047   1.784  1.00  0.00           C  
HETATM   20  C   UNL     1       5.112   0.442   1.690  1.00  0.00           C  
HETATM   21  C   UNL     1       4.041  -2.049   0.792  1.00  0.00           C  
HETATM   22  C   UNL     1       4.624   0.253   0.253  1.00  0.00           C  
HETATM   23  C   UNL     1       3.171   0.641   0.160  1.00  0.00           C  
HETATM   24  C   UNL     1       2.674   1.868   0.344  1.00  0.00           C  
HETATM   25  C   UNL     1       0.708   0.906  -0.084  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.756   0.825  -0.277  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.353  -0.403  -0.593  1.00  0.00           C  
HETATM   28  N   UNL     1       1.373   1.986   0.210  1.00  0.00           N  
HETATM   29  N   UNL     1      -4.859   0.851  -0.768  1.00  0.00           N  
HETATM   30  N   UNL     1      -7.077  -0.002   1.049  1.00  0.00           N  
HETATM   31  S   UNL     1       1.833  -0.443  -0.216  1.00  0.00           S  
HETATM   32  H   UNL     1       3.416  -0.678  -1.681  1.00  0.00           H  
HETATM   33  H   UNL     1       4.984  -1.325  -2.235  1.00  0.00           H  
HETATM   34  H   UNL     1       2.551  -2.798  -1.673  1.00  0.00           H  
HETATM   35  H   UNL     1       4.133  -3.453  -2.192  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.149  -1.447  -1.014  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.410  -0.897  -1.788  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.720   0.285  -1.552  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.393  -1.263   0.727  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.711  -1.906  -1.100  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.663  -3.015  -0.167  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.255  -1.928   0.605  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.208  -3.038   1.539  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.728  -0.427   2.322  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.216  -1.288   2.740  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.133   2.604  -0.573  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.934   3.897  -0.050  1.00  0.00           H  
HETATM   48  H   UNL     1       3.015  -3.924   0.326  1.00  0.00           H  
HETATM   49  H   UNL     1       4.780  -3.952   0.007  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.081   2.914   0.098  1.00  0.00           H  
HETATM   51  H   UNL     1       5.332   2.180  -0.398  1.00  0.00           H  
HETATM   52  H   UNL     1       5.101   1.001  -1.710  1.00  0.00           H  
HETATM   53  H   UNL     1       7.040  -0.303  -0.881  1.00  0.00           H  
HETATM   54  H   UNL     1       7.511   1.370  -1.261  1.00  0.00           H  
HETATM   55  H   UNL     1       8.463   0.649   0.912  1.00  0.00           H  
HETATM   56  H   UNL     1       7.296   1.975   1.134  1.00  0.00           H  
HETATM   57  H   UNL     1       6.703  -0.997   1.495  1.00  0.00           H  
HETATM   58  H   UNL     1       6.935   0.182   2.808  1.00  0.00           H  
HETATM   59  H   UNL     1       4.524  -0.187   2.359  1.00  0.00           H  
HETATM   60  H   UNL     1       4.996   1.486   1.979  1.00  0.00           H  
HETATM   61  H   UNL     1       4.625  -2.236   1.693  1.00  0.00           H  
HETATM   62  H   UNL     1       3.069  -1.624   1.043  1.00  0.00           H  
HETATM   63  H   UNL     1       3.305   2.711   0.588  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.739  -1.285  -0.694  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.698   0.568   0.495  1.00  0.00           H  
CONECT    1   21    2   22                                            
CONECT    2    3    1   32   33                                       
CONECT    3   14    2   34   35                                       
CONECT    4   27   27    5   36                                       
CONECT    5    4   29   13   13                                       
CONECT    6    7   29   37   38                                       
CONECT    7   30    6    8   39                                       
CONECT    8    7    9   40   41                                       
CONECT    9   10    8   42   43                                       
CONECT   10   30    9   44   45                                       
CONECT   11   29   12   12   46                                       
CONECT   12   11   11   13   47                                       
CONECT   13    5    5   15   12                                       
CONECT   14   21    3   48   49                                       
CONECT   15   26   26   13   50                                       
CONECT   16   22   17   51   52                                       
CONECT   17   16   18   53   54                                       
CONECT   18   19   17   55   56                                       
CONECT   19   20   18   57   58                                       
CONECT   20   22   19   59   60                                       
CONECT   21   14    1   61   62                                       
CONECT   22   23    1   20   16                                       
CONECT   23   24   24   31   22                                       
CONECT   24   28   23   23   63                                       
CONECT   25   28   28   26   31                                       
CONECT   26   27   25   15   15                                       
CONECT   27    4    4   26   64                                       
CONECT   28   24   25   25                                            
CONECT   29    6    5   11                                            
CONECT   30   10    7   65                                            
CONECT   31   25   23                                                 
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   21                                                      
CONECT   63   24                                                      
CONECT   64   27                                                      
CONECT   65   30                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
