COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.350  -0.334   0.395  1.00  0.00           C  
HETATM    2  C   UNL     1       5.322  -2.077  -1.034  1.00  0.00           C  
HETATM    3  C   UNL     1       5.861  -3.415  -0.516  1.00  0.00           C  
HETATM    4  C   UNL     1       7.173  -2.339   1.182  1.00  0.00           C  
HETATM    5  C   UNL     1       6.700  -0.945   0.751  1.00  0.00           C  
HETATM    6  O   UNL     1       4.417   0.412   1.353  1.00  0.00           O  
HETATM    7  O   UNL     1       7.158  -3.213   0.050  1.00  0.00           O  
HETATM    8  N   UNL     1       5.413  -1.087   0.051  1.00  0.00           N  
HETATM    9  N   UNL     1       3.210  -0.412  -0.320  1.00  0.00           N  
HETATM   10  C   UNL     1       2.089   0.480  -0.012  1.00  0.00           C  
HETATM   11  C   UNL     1       2.230   1.773  -0.818  1.00  0.00           C  
HETATM   12  C   UNL     1       1.129   2.753  -0.406  1.00  0.00           C  
HETATM   13  C   UNL     1       1.340   3.174   1.050  1.00  0.00           C  
HETATM   14  C   UNL     1       0.240   4.154   1.462  1.00  0.00           C  
HETATM   15  C   UNL     1       0.293   5.389   0.560  1.00  0.00           C  
HETATM   16  C   UNL     1       0.082   4.968  -0.895  1.00  0.00           C  
HETATM   17  C   UNL     1       1.183   3.988  -1.307  1.00  0.00           C  
HETATM   18  C   UNL     1       0.793  -0.199  -0.372  1.00  0.00           C  
HETATM   19  O   UNL     1       0.795  -1.147  -1.128  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.776   0.238   0.577  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.502  -1.904   0.403  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.368   0.248   0.147  1.00  0.00           N  
HETATM   23  O   UNL     1      -3.992  -0.464   0.314  1.00  0.00           O  
HETATM   24  C   UNL     1      -5.144   0.120   0.926  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.363  -0.697   0.583  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.746  -1.744   1.401  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.864  -2.493   1.087  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.600  -2.196  -0.045  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.218  -1.149  -0.862  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.103  -0.396  -0.545  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.862  -0.500  -1.574  1.00  0.00           C  
HETATM   32  N   UNL     1      -2.052  -0.522  -2.694  1.00  0.00           N  
HETATM   33  C   UNL     1      -1.615  -0.472  -0.123  1.00  0.00           C  
HETATM   34  H   UNL     1       5.918  -1.745  -1.884  1.00  0.00           H  
HETATM   35  H   UNL     1       4.282  -2.193  -1.338  1.00  0.00           H  
HETATM   36  H   UNL     1       5.188  -3.808   0.247  1.00  0.00           H  
HETATM   37  H   UNL     1       5.930  -4.124  -1.341  1.00  0.00           H  
HETATM   38  H   UNL     1       8.186  -2.274   1.579  1.00  0.00           H  
HETATM   39  H   UNL     1       6.505  -2.728   1.951  1.00  0.00           H  
HETATM   40  H   UNL     1       6.573  -0.312   1.629  1.00  0.00           H  
HETATM   41  H   UNL     1       7.435  -0.499   0.080  1.00  0.00           H  
HETATM   42  H   UNL     1       3.131  -1.059  -1.039  1.00  0.00           H  
HETATM   43  H   UNL     1       2.093   0.714   1.053  1.00  0.00           H  
HETATM   44  H   UNL     1       3.205   2.219  -0.623  1.00  0.00           H  
HETATM   45  H   UNL     1       2.138   1.549  -1.881  1.00  0.00           H  
HETATM   46  H   UNL     1       0.157   2.271  -0.507  1.00  0.00           H  
HETATM   47  H   UNL     1       1.302   2.294   1.692  1.00  0.00           H  
HETATM   48  H   UNL     1       2.313   3.656   1.151  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.732   3.672   1.360  1.00  0.00           H  
HETATM   50  H   UNL     1       0.390   4.454   2.499  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.491   6.087   0.854  1.00  0.00           H  
HETATM   52  H   UNL     1       1.266   5.871   0.661  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.890   4.486  -0.997  1.00  0.00           H  
HETATM   54  H   UNL     1       0.120   5.848  -1.538  1.00  0.00           H  
HETATM   55  H   UNL     1       2.155   4.470  -1.206  1.00  0.00           H  
HETATM   56  H   UNL     1       1.032   3.687  -2.344  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.856   1.258   0.203  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.593   0.259   1.652  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.320  -1.884   1.477  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.430  -2.440   0.202  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.675  -2.410  -0.096  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.378   1.045   0.699  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.011   0.138   2.007  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.274   1.138   0.558  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.170  -1.977   2.285  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.162  -3.312   1.725  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.473  -2.782  -0.290  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.792  -0.916  -1.747  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.806   0.425  -1.181  1.00  0.00           H  
CONECT    1    8    9    6    6                                       
CONECT    2    3    8   34   35                                       
CONECT    3    7    2   36   37                                       
CONECT    4    7    5   38   39                                       
CONECT    5    4    8   40   41                                       
CONECT    6    1    1                                                 
CONECT    7    4    3                                                 
CONECT    8    5    2    1                                            
CONECT    9    1   10   42                                            
CONECT   10    9   11   18   43                                       
CONECT   11   12   10   44   45                                       
CONECT   12   13   11   17   46                                       
CONECT   13   14   12   47   48                                       
CONECT   14   13   15   49   50                                       
CONECT   15   14   16   51   52                                       
CONECT   16   15   17   53   54                                       
CONECT   17   12   16   55   56                                       
CONECT   18   19   19   10   22                                       
CONECT   19   18   18                                                 
CONECT   20   33   23   57   58                                       
CONECT   21   33   59   60   61                                       
CONECT   22   18   33   62                                            
CONECT   23   20   24                                                 
CONECT   24   23   25   63   64                                       
CONECT   25   24   30   30   26                                       
CONECT   26   25   27   27   65                                       
CONECT   27   26   26   28   66                                       
CONECT   28   29   29   27   67                                       
CONECT   29   30   28   28   68                                       
CONECT   30   25   25   29   69                                       
CONECT   31   32   32   32   33                                       
CONECT   32   31   31   31                                            
CONECT   33   22   31   21   20                                       
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   20                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   30                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
