COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.818  -5.076   0.781  1.00  0.00           C  
HETATM    2  C   UNL     1       5.081  -2.720   0.364  1.00  0.00           C  
HETATM    3  C   UNL     1       5.694  -1.548  -0.029  1.00  0.00           C  
HETATM    4  C   UNL     1       7.063  -1.837  -0.220  1.00  0.00           C  
HETATM    5  C   UNL     1       5.060  -0.277  -0.210  1.00  0.00           C  
HETATM    6  C   UNL     1       4.540   0.765  -0.358  1.00  0.00           C  
HETATM    7  C   UNL     1       4.041   4.375  -1.118  1.00  0.00           C  
HETATM    8  C   UNL     1       2.687   4.533  -0.905  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.225   2.475   0.104  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.433   0.172   0.676  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.562   0.386   1.456  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.345  -0.684   1.843  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.882  -2.184   0.679  1.00  0.00           C  
HETATM   14  C   UNL     1       1.683   1.058   0.096  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.665   1.158   0.382  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.307  -0.139   0.169  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.357  -0.863  -1.038  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.057  -1.464  -3.243  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.763  -2.651  -3.022  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.254  -2.913  -1.784  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.992  -0.909   1.137  1.00  0.00           C  
HETATM   22  N   UNL     1       6.030  -3.675   0.410  1.00  0.00           N  
HETATM   23  N   UNL     1       7.252  -3.101   0.043  1.00  0.00           N  
HETATM   24  C   UNL     1       3.907   2.036  -0.539  1.00  0.00           C  
HETATM   25  C   UNL     1       4.650   3.145  -0.942  1.00  0.00           C  
HETATM   26  C   UNL     1       1.913   3.442  -0.506  1.00  0.00           C  
HETATM   27  C   UNL     1       0.472   3.559  -0.273  1.00  0.00           C  
HETATM   28  N   UNL     1       0.363   1.254   0.282  1.00  0.00           N  
HETATM   29  C   UNL     1      -2.006  -1.967   1.456  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.092  -1.119   0.292  1.00  0.00           C  
HETATM   31  O   UNL     1       2.171  -0.046   0.264  1.00  0.00           O  
HETATM   32  C   UNL     1       2.522   2.180  -0.322  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.708   2.609   0.333  1.00  0.00           C  
HETATM   34  C   UNL     1      -1.963   3.053   1.775  1.00  0.00           C  
HETATM   35  N   UNL     1      -2.357   1.316   0.099  1.00  0.00           N  
HETATM   36  O   UNL     1      -4.312   2.093   0.816  1.00  0.00           O  
HETATM   37  N   UNL     1      -3.876  -0.612  -2.257  1.00  0.00           N  
HETATM   38  N   UNL     1      -5.050  -2.012  -0.784  1.00  0.00           N  
HETATM   39  N   UNL     1      -5.426  -2.007   0.564  1.00  0.00           N  
HETATM   40  N   UNL     1      -5.174  -0.561   2.471  1.00  0.00           N  
HETATM   41  H   UNL     1       5.580  -5.656  -0.110  1.00  0.00           H  
HETATM   42  H   UNL     1       6.725  -5.472   1.240  1.00  0.00           H  
HETATM   43  H   UNL     1       4.993  -5.144   1.490  1.00  0.00           H  
HETATM   44  H   UNL     1       4.034  -2.848   0.597  1.00  0.00           H  
HETATM   45  H   UNL     1       7.822  -1.133  -0.531  1.00  0.00           H  
HETATM   46  H   UNL     1       4.633   5.223  -1.431  1.00  0.00           H  
HETATM   47  H   UNL     1       2.227   5.500  -1.046  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.828   1.388   1.759  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.223  -0.518   2.450  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.620  -3.187   0.378  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.661  -1.245  -4.224  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.914  -3.353  -3.829  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.802  -3.825  -1.594  1.00  0.00           H  
HETATM   54  H   UNL     1       5.711   3.043  -1.119  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.025   4.509  -0.405  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.622  -2.802   1.757  1.00  0.00           H  
HETATM   57  H   UNL     1       0.785  -1.289  -0.314  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.117   3.350  -0.353  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.238   4.108   1.787  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.775   2.462   2.199  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.059   2.907   2.366  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.845   0.575  -0.261  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.961   0.336   2.772  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.514  -1.216   3.101  1.00  0.00           H  
CONECT    1   22   41   42   43                                       
CONECT    2    3    3   22   44                                       
CONECT    3    5    2    2    4                                       
CONECT    4    3   23   23   45                                       
CONECT    5    6    6    6    3                                       
CONECT    6   24    5    5    5                                       
CONECT    7    8    8   25   46                                       
CONECT    8   26    7    7   47                                       
CONECT    9   33   28   27   27                                       
CONECT   10   30   30   11   28                                       
CONECT   11   12   12   10   48                                       
CONECT   12   29   11   11   49                                       
CONECT   13   29   29   30   50                                       
CONECT   14   28   31   31   32                                       
CONECT   15   16   36   36   35                                       
CONECT   16   21   17   17   15                                       
CONECT   17   38   16   16   37                                       
CONECT   18   19   37   37   51                                       
CONECT   19   20   20   18   52                                       
CONECT   20   38   19   19   53                                       
CONECT   21   39   39   40   16                                       
CONECT   22    2    1   23                                            
CONECT   23   22    4    4                                            
CONECT   24   32    6   25   25                                       
CONECT   25   24   24    7   54                                       
CONECT   26   27   32   32    8                                       
CONECT   27    9    9   26   55                                       
CONECT   28   10    9   14                                            
CONECT   29   13   13   12   56                                       
CONECT   30   13   10   10   57                                       
CONECT   31   14   14                                                 
CONECT   32   14   26   26   24                                       
CONECT   33   35   34    9   58                                       
CONECT   34   33   59   60   61                                       
CONECT   35   15   33   62                                            
CONECT   36   15   15                                                 
CONECT   37   17   18   18                                            
CONECT   38   20   39   17                                            
CONECT   39   38   21   21                                            
CONECT   40   21   63   64                                            
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    2                                                      
CONECT   45    4                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   33                                                      
CONECT   59   34                                                      
CONECT   60   34                                                      
CONECT   61   34                                                      
CONECT   62   35                                                      
CONECT   63   40                                                      
CONECT   64   40                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
