COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.540  -0.797  -3.582  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.853  -0.423  -1.322  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.042   0.796   0.381  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.494  -0.005  -2.528  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.511   2.101   0.385  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.720   2.400   0.983  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.843   0.488  -0.261  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.473   1.399   1.573  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.018   0.099   1.584  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.786  -0.217   1.001  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.689   1.060   0.136  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.535   0.755  -0.490  1.00  0.00           N  
HETATM   13  C   UNL     1       0.719   1.377  -0.058  1.00  0.00           C  
HETATM   14  C   UNL     1       1.868   0.864  -0.928  1.00  0.00           C  
HETATM   15  C   UNL     1       3.097   2.939  -0.716  1.00  0.00           C  
HETATM   16  N   UNL     1       3.126   1.488  -0.495  1.00  0.00           N  
HETATM   17  N   UNL     1      -3.598  -2.222   0.135  1.00  0.00           N  
HETATM   18  C   UNL     1      -4.269  -1.587   1.084  1.00  0.00           C  
HETATM   19  O   UNL     1      -4.476  -2.195   2.116  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.272  -1.736  -1.128  1.00  0.00           C  
HETATM   21  C   UNL     1       4.358   3.572  -0.123  1.00  0.00           C  
HETATM   22  C   UNL     1       5.593   2.959  -0.789  1.00  0.00           C  
HETATM   23  C   UNL     1       5.573   1.442  -0.585  1.00  0.00           C  
HETATM   24  C   UNL     1       4.277   0.871  -1.165  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.356  -2.585  -2.227  1.00  0.00           C  
HETATM   26  C   UNL     1       4.244  -0.643  -0.946  1.00  0.00           C  
HETATM   27  C   UNL     1       3.176  -0.617   1.227  1.00  0.00           C  
HETATM   28  C   UNL     1       3.410  -0.843   2.722  1.00  0.00           C  
HETATM   29  C   UNL     1       2.181  -0.380   3.506  1.00  0.00           C  
HETATM   30  C   UNL     1       4.801  -2.332   0.697  1.00  0.00           C  
HETATM   31  C   UNL     1       6.284  -2.498   0.358  1.00  0.00           C  
HETATM   32  C   UNL     1       6.670  -3.975   0.469  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.982  -2.099  -3.472  1.00  0.00           C  
HETATM   34  N   UNL     1       4.404  -0.934   0.485  1.00  0.00           N  
HETATM   35  O   UNL     1      -1.689   1.850   1.060  1.00  0.00           O  
HETATM   36  H   UNL     1      -2.231  -0.419  -4.545  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.930   2.885  -0.079  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.078   3.419   0.990  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.424   1.639   2.027  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.612  -0.677   2.043  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.535   0.125  -1.227  1.00  0.00           H  
HETATM   42  H   UNL     1       0.641   2.460  -0.160  1.00  0.00           H  
HETATM   43  H   UNL     1       0.910   1.123   0.984  1.00  0.00           H  
HETATM   44  H   UNL     1       1.946  -0.218  -0.826  1.00  0.00           H  
HETATM   45  H   UNL     1       1.677   1.118  -1.970  1.00  0.00           H  
HETATM   46  H   UNL     1       3.058   3.142  -1.786  1.00  0.00           H  
HETATM   47  H   UNL     1       2.217   3.363  -0.233  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.303  -3.122   0.342  1.00  0.00           H  
HETATM   49  H   UNL     1       4.344   4.647  -0.301  1.00  0.00           H  
HETATM   50  H   UNL     1       4.390   3.381   0.950  1.00  0.00           H  
HETATM   51  H   UNL     1       5.580   3.184  -1.856  1.00  0.00           H  
HETATM   52  H   UNL     1       6.494   3.376  -0.339  1.00  0.00           H  
HETATM   53  H   UNL     1       6.428   0.996  -1.094  1.00  0.00           H  
HETATM   54  H   UNL     1       5.625   1.217   0.480  1.00  0.00           H  
HETATM   55  H   UNL     1       4.233   1.084  -2.233  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.705  -3.601  -2.114  1.00  0.00           H  
HETATM   57  H   UNL     1       3.290  -1.040  -1.293  1.00  0.00           H  
HETATM   58  H   UNL     1       5.057  -1.109  -1.504  1.00  0.00           H  
HETATM   59  H   UNL     1       2.368  -1.264   0.884  1.00  0.00           H  
HETATM   60  H   UNL     1       2.906   0.424   1.054  1.00  0.00           H  
HETATM   61  H   UNL     1       3.581  -1.903   2.907  1.00  0.00           H  
HETATM   62  H   UNL     1       4.282  -0.273   3.043  1.00  0.00           H  
HETATM   63  H   UNL     1       2.010   0.680   3.321  1.00  0.00           H  
HETATM   64  H   UNL     1       1.309  -0.951   3.185  1.00  0.00           H  
HETATM   65  H   UNL     1       2.348  -0.541   4.571  1.00  0.00           H  
HETATM   66  H   UNL     1       4.206  -2.980   0.054  1.00  0.00           H  
HETATM   67  H   UNL     1       4.634  -2.603   1.740  1.00  0.00           H  
HETATM   68  H   UNL     1       6.464  -2.151  -0.659  1.00  0.00           H  
HETATM   69  H   UNL     1       6.883  -1.912   1.054  1.00  0.00           H  
HETATM   70  H   UNL     1       6.489  -4.322   1.486  1.00  0.00           H  
HETATM   71  H   UNL     1       6.070  -4.561  -0.228  1.00  0.00           H  
HETATM   72  H   UNL     1       7.726  -4.093   0.227  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.037  -2.733  -4.344  1.00  0.00           H  
CONECT    1   33   33    4   36                                       
CONECT    2   20    7    4    4                                       
CONECT    3    7   10   10    5                                       
CONECT    4    2    2    1                                            
CONECT    5    3    6    6   37                                       
CONECT    6    5    5    8   38                                       
CONECT    7   11    2    3                                            
CONECT    8    9    9    6   39                                       
CONECT    9   10    8    8   40                                       
CONECT   10   18    3    3    9                                       
CONECT   11   35   35   12    7                                       
CONECT   12   13   11   41                                            
CONECT   13   14   12   42   43                                       
CONECT   14   16   13   44   45                                       
CONECT   15   21   16   46   47                                       
CONECT   16   24   15   14                                            
CONECT   17   18   20   48                                            
CONECT   18   19   19   17   10                                       
CONECT   19   18   18                                                 
CONECT   20   17   25   25    2                                       
CONECT   21   22   15   49   50                                       
CONECT   22   23   21   51   52                                       
CONECT   23   22   24   53   54                                       
CONECT   24   26   23   16   55                                       
CONECT   25   20   20   33   56                                       
CONECT   26   24   34   57   58                                       
CONECT   27   34   28   59   60                                       
CONECT   28   27   29   61   62                                       
CONECT   29   28   63   64   65                                       
CONECT   30   34   31   66   67                                       
CONECT   31   30   32   68   69                                       
CONECT   32   31   70   71   72                                       
CONECT   33   25    1    1   73                                       
CONECT   34   26   30   27                                            
CONECT   35   11   11                                                 
CONECT   36    1                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   29                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
