COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.973  -6.131  -0.264  1.00  0.00           C  
HETATM    2  C   UNL     1       2.471  -5.845  -0.323  1.00  0.00           C  
HETATM    3  C   UNL     1       2.201  -4.428   0.186  1.00  0.00           C  
HETATM    4  N   UNL     1       0.763  -4.155   0.129  1.00  0.00           N  
HETATM    5  C   UNL     1       0.288  -2.959   0.531  1.00  0.00           C  
HETATM    6  O   UNL     1       1.053  -2.108   0.940  1.00  0.00           O  
HETATM    7  O   UNL     1      -1.034  -2.707   0.479  1.00  0.00           O  
HETATM    8  C   UNL     1      -1.474  -1.399   0.927  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.995  -1.299   0.795  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.465   0.062   1.317  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.171   0.811   0.179  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.357  -0.035  -0.302  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.834  -1.393  -0.780  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.374  -1.437  -0.618  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.723  -0.409  -1.442  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.185   0.977  -0.983  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.995   1.780  -0.525  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.697   1.440  -0.687  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.038   2.968   0.115  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.250   3.703   0.484  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.721   3.378   0.363  1.00  0.00           N  
HETATM   22  C   UNL     1       0.090   2.460  -0.118  1.00  0.00           C  
HETATM   23  C   UNL     1       1.573   2.495  -0.071  1.00  0.00           C  
HETATM   24  C   UNL     1       2.228   3.570   0.526  1.00  0.00           C  
HETATM   25  C   UNL     1       3.606   3.600   0.567  1.00  0.00           C  
HETATM   26  C   UNL     1       4.341   2.560   0.015  1.00  0.00           C  
HETATM   27  O   UNL     1       5.699   2.592   0.057  1.00  0.00           O  
HETATM   28  C   UNL     1       6.392   1.489  -0.530  1.00  0.00           C  
HETATM   29  C   UNL     1       3.692   1.487  -0.580  1.00  0.00           C  
HETATM   30  C   UNL     1       2.313   1.449  -0.620  1.00  0.00           C  
HETATM   31  H   UNL     1       4.504  -5.413  -0.888  1.00  0.00           H  
HETATM   32  H   UNL     1       4.319  -6.043   0.766  1.00  0.00           H  
HETATM   33  H   UNL     1       4.166  -7.141  -0.626  1.00  0.00           H  
HETATM   34  H   UNL     1       2.125  -5.934  -1.353  1.00  0.00           H  
HETATM   35  H   UNL     1       1.940  -6.563   0.302  1.00  0.00           H  
HETATM   36  H   UNL     1       2.547  -4.340   1.216  1.00  0.00           H  
HETATM   37  H   UNL     1       2.733  -3.710  -0.439  1.00  0.00           H  
HETATM   38  H   UNL     1       0.153  -4.834  -0.198  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.190  -1.258   1.970  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.005  -0.628   0.315  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.463  -2.093   1.376  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.160  -0.085   2.144  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.606   0.639   1.656  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.509   1.787   0.527  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.058  -0.183   0.520  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.859   0.474  -1.124  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.289  -2.187  -0.188  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.088  -1.531  -1.830  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.641  -0.486  -1.332  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.994  -0.555  -2.487  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.677   1.490  -1.810  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.329   0.546  -1.167  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.571   3.397   1.480  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.043   4.773   0.481  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.041   3.484  -0.235  1.00  0.00           H  
HETATM   56  H   UNL     1       1.656   4.380   0.955  1.00  0.00           H  
HETATM   57  H   UNL     1       4.114   4.433   1.030  1.00  0.00           H  
HETATM   58  H   UNL     1       6.105   0.568  -0.023  1.00  0.00           H  
HETATM   59  H   UNL     1       6.134   1.418  -1.586  1.00  0.00           H  
HETATM   60  H   UNL     1       7.467   1.640  -0.428  1.00  0.00           H  
HETATM   61  H   UNL     1       4.266   0.679  -1.009  1.00  0.00           H  
HETATM   62  H   UNL     1       1.809   0.612  -1.079  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4   36   37                                       
CONECT    4    3    5   38                                            
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    8                                                 
CONECT    8    7    9   39   40                                       
CONECT    9    8   14   10   41                                       
CONECT   10    9   11   42   43                                       
CONECT   11   10   12   16   44                                       
CONECT   12   13   11   45   46                                       
CONECT   13   14   12   47   48                                       
CONECT   14    9   13   15                                            
CONECT   15   14   16   49   50                                       
CONECT   16   15   11   17   51                                       
CONECT   17   16   19   18   18                                       
CONECT   18   17   17   22   52                                       
CONECT   19   17   20   21                                            
CONECT   20   19   53   54   55                                       
CONECT   21   19   22   22                                            
CONECT   22   18   21   21   23                                       
CONECT   23   22   24   24   30                                       
CONECT   24   23   23   25   56                                       
CONECT   25   24   26   26   57                                       
CONECT   26   25   25   29   27                                       
CONECT   27   26   28                                                 
CONECT   28   27   58   59   60                                       
CONECT   29   30   30   26   61                                       
CONECT   30   23   29   29   62                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   28                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
