COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.477  -0.644   0.240  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.867  -0.609   0.798  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.901   0.283   0.102  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.541   2.241   0.378  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.437   1.450   1.088  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.138   0.040   0.138  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.100  -0.949  -0.396  1.00  0.00           C  
HETATM    8  C   UNL     1       0.210  -1.046  -0.954  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.589  -1.809  -0.078  1.00  0.00           O  
HETATM   10  C   UNL     1       5.537   2.270  -0.787  1.00  0.00           C  
HETATM   11  C   UNL     1       4.631   2.733  -1.668  1.00  0.00           C  
HETATM   12  C   UNL     1       3.311   2.247  -1.661  1.00  0.00           C  
HETATM   13  O   UNL     1      -7.802   1.612   0.620  1.00  0.00           O  
HETATM   14  C   UNL     1       2.945   1.300  -0.752  1.00  0.00           C  
HETATM   15  C   UNL     1       1.475  -0.478  -1.074  1.00  0.00           C  
HETATM   16  C   UNL     1       2.532  -1.242  -1.544  1.00  0.00           C  
HETATM   17  C   UNL     1       0.014  -2.373  -1.300  1.00  0.00           C  
HETATM   18  C   UNL     1       2.328  -2.564  -1.892  1.00  0.00           C  
HETATM   19  C   UNL     1       1.072  -3.129  -1.768  1.00  0.00           C  
HETATM   20  C   UNL     1       3.907   0.820   0.173  1.00  0.00           C  
HETATM   21  C   UNL     1       3.829  -0.115   1.184  1.00  0.00           C  
HETATM   22  C   UNL     1       5.106  -0.187   1.780  1.00  0.00           C  
HETATM   23  C   UNL     1       5.487  -1.030   2.873  1.00  0.00           C  
HETATM   24  C   UNL     1       5.921   0.706   1.112  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.549   0.037   0.690  1.00  0.00           N  
HETATM   26  N   UNL     1       5.194   1.314   0.140  1.00  0.00           N  
HETATM   27  N   UNL     1       5.789  -1.699   3.740  1.00  0.00           N  
HETATM   28  O   UNL     1      -0.830  -0.301  -0.492  1.00  0.00           O  
HETATM   29  O   UNL     1       1.674   0.822  -0.731  1.00  0.00           O  
HETATM   30  H   UNL     1      -7.132  -0.728   1.849  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.839  -1.585   0.314  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.709   0.295  -0.970  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.902  -0.106   0.289  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.563   3.261   0.763  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.343   2.261  -0.694  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.461   1.837   0.794  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.558   1.538   2.167  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.214   0.888  -0.541  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.833   0.390   1.124  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.023  -1.798   0.284  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.405  -1.299  -1.382  1.00  0.00           H  
HETATM   42  H   UNL     1       6.548   2.651  -0.811  1.00  0.00           H  
HETATM   43  H   UNL     1       4.921   3.484  -2.388  1.00  0.00           H  
HETATM   44  H   UNL     1       2.590   2.624  -2.372  1.00  0.00           H  
HETATM   45  H   UNL     1       3.515  -0.804  -1.638  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.966  -2.817  -1.204  1.00  0.00           H  
HETATM   47  H   UNL     1       3.152  -3.158  -2.259  1.00  0.00           H  
HETATM   48  H   UNL     1       0.918  -4.163  -2.038  1.00  0.00           H  
HETATM   49  H   UNL     1       2.955  -0.684   1.467  1.00  0.00           H  
HETATM   50  H   UNL     1       6.963   0.890   1.328  1.00  0.00           H  
CONECT    1    9    9    6   25                                       
CONECT    2   25    3   30   31                                       
CONECT    3    2   13   32   33                                       
CONECT    4    5   13   34   35                                       
CONECT    5   25    4   36   37                                       
CONECT    6    7    1   38   39                                       
CONECT    7    6   28   40   41                                       
CONECT    8   17   28   15   15                                       
CONECT    9    1    1                                                 
CONECT   10   11   11   26   42                                       
CONECT   11   12   10   10   43                                       
CONECT   12   14   14   11   44                                       
CONECT   13    3    4                                                 
CONECT   14   29   12   12   20                                       
CONECT   15    8    8   16   29                                       
CONECT   16   18   18   15   45                                       
CONECT   17   19   19    8   46                                       
CONECT   18   19   16   16   47                                       
CONECT   19   17   17   18   48                                       
CONECT   20   14   26   21   21                                       
CONECT   21   20   20   22   49                                       
CONECT   22   21   24   24   23                                       
CONECT   23   22   27   27   27                                       
CONECT   24   26   22   22   50                                       
CONECT   25    1    2    5                                            
CONECT   26   20   10   24                                            
CONECT   27   23   23   23                                            
CONECT   28    7    8                                                 
CONECT   29   15   14                                                 
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
