COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.094   3.130   0.401  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.345   3.571   0.198  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.294  -0.598  -0.478  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.520  -1.963  -0.435  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.446   0.348  -0.701  1.00  0.00           C  
HETATM    6  C   UNL     1       0.278  -4.321  -0.179  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.898  -0.017   0.220  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.268  -0.182   0.021  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.092   0.918  -0.132  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.570   2.195  -0.104  1.00  0.00           C  
HETATM   11  C   UNL     1       1.083  -5.010  -1.283  1.00  0.00           C  
HETATM   12  C   UNL     1       0.708  -4.870   1.183  1.00  0.00           C  
HETATM   13  C   UNL     1       4.934   1.406   0.201  1.00  0.00           C  
HETATM   14  C   UNL     1       6.002   0.540   0.409  1.00  0.00           C  
HETATM   15  C   UNL     1       5.764  -0.833   0.443  1.00  0.00           C  
HETATM   16  C   UNL     1       4.488  -1.323   0.279  1.00  0.00           C  
HETATM   17  C   UNL     1       3.421  -0.449   0.078  1.00  0.00           C  
HETATM   18  C   UNL     1       3.657   0.924   0.035  1.00  0.00           C  
HETATM   19  C   UNL     1       5.497   2.814   0.203  1.00  0.00           C  
HETATM   20  C   UNL     1       7.012   2.552   0.027  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.083   1.761   0.440  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.354   1.278   0.265  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.203   2.386   0.099  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.890   0.936   0.640  1.00  0.00           C  
HETATM   25  C   UNL     1       0.532  -2.836  -0.225  1.00  0.00           C  
HETATM   26  C   UNL     1       1.813  -2.350  -0.058  1.00  0.00           C  
HETATM   27  C   UNL     1       2.046  -0.977  -0.101  1.00  0.00           C  
HETATM   28  C   UNL     1       0.982  -0.102  -0.312  1.00  0.00           C  
HETATM   29  O   UNL     1       7.169   1.225   0.557  1.00  0.00           O  
HETATM   30  N   UNL     1       4.965   3.594  -0.922  1.00  0.00           N  
HETATM   31  O   UNL     1      -1.034   1.403  -1.571  1.00  0.00           O  
HETATM   32  C   UNL     1      -4.025  -1.194   0.383  1.00  0.00           C  
HETATM   33  O   UNL     1      -3.984  -2.140  -0.576  1.00  0.00           O  
HETATM   34  O   UNL     1      -3.343  -1.311   1.381  1.00  0.00           O  
HETATM   35  H   UNL     1      -2.225   3.761   0.512  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.660   4.601   0.122  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.521  -2.347  -0.565  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.278  -0.193  -1.154  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.784  -4.513  -0.330  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.688  -1.176  -0.014  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.151   0.776  -0.287  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.223   3.047  -0.225  1.00  0.00           H  
HETATM   43  H   UNL     1       0.900  -6.084  -1.250  1.00  0.00           H  
HETATM   44  H   UNL     1       0.777  -4.619  -2.254  1.00  0.00           H  
HETATM   45  H   UNL     1       2.145  -4.818  -1.133  1.00  0.00           H  
HETATM   46  H   UNL     1       0.135  -4.379   1.969  1.00  0.00           H  
HETATM   47  H   UNL     1       0.525  -5.944   1.216  1.00  0.00           H  
HETATM   48  H   UNL     1       1.770  -4.677   1.334  1.00  0.00           H  
HETATM   49  H   UNL     1       6.585  -1.516   0.599  1.00  0.00           H  
HETATM   50  H   UNL     1       4.313  -2.389   0.307  1.00  0.00           H  
HETATM   51  H   UNL     1       2.836   1.610  -0.120  1.00  0.00           H  
HETATM   52  H   UNL     1       5.296   3.313   1.151  1.00  0.00           H  
HETATM   53  H   UNL     1       7.289   2.583  -1.026  1.00  0.00           H  
HETATM   54  H   UNL     1       7.597   3.269   0.603  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.120   0.127   1.333  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.088   1.549   1.051  1.00  0.00           H  
HETATM   57  H   UNL     1       2.634  -3.033   0.105  1.00  0.00           H  
HETATM   58  H   UNL     1       1.157   0.964  -0.347  1.00  0.00           H  
HETATM   59  H   UNL     1       5.339   4.531  -0.922  1.00  0.00           H  
HETATM   60  H   UNL     1       5.148   3.132  -1.801  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.296   1.928  -1.231  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.397  -2.893  -0.425  1.00  0.00           H  
CONECT    1    2    2   21   35                                       
CONECT    2    1    1   23   36                                       
CONECT    3    5   28   28    4                                       
CONECT    4    3   25   25   37                                       
CONECT    5   24   31    3   38                                       
CONECT    6   25   11   12   39                                       
CONECT    7   22   22    8   32                                       
CONECT    8    9    9    7   40                                       
CONECT    9   10    8    8   41                                       
CONECT   10   23   23    9   42                                       
CONECT   11    6   43   44   45                                       
CONECT   12    6   46   47   48                                       
CONECT   13   18   19   14   14                                       
CONECT   14   13   13   15   29                                       
CONECT   15   16   16   14   49                                       
CONECT   16   17   15   15   50                                       
CONECT   17   27   18   18   16                                       
CONECT   18   17   17   13   51                                       
CONECT   19   13   20   30   52                                       
CONECT   20   19   29   53   54                                       
CONECT   21    1   22   24                                            
CONECT   22   23   21    7    7                                       
CONECT   23    2   10   10   22                                       
CONECT   24   21    5   55   56                                       
CONECT   25    4    4   26    6                                       
CONECT   26   27   27   25   57                                       
CONECT   27   28   17   26   26                                       
CONECT   28    3    3   27   58                                       
CONECT   29   14   20                                                 
CONECT   30   19   59   60                                            
CONECT   31    5   61                                                 
CONECT   32    7   34   34   33                                       
CONECT   33   32   62                                                 
CONECT   34   32   32                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   26                                                      
CONECT   58   28                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   33                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
