COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.336   2.389  -0.250  1.00  0.00           C  
HETATM    2  C   UNL     1       4.824   1.160   0.121  1.00  0.00           C  
HETATM    3  C   UNL     1       5.436   0.429   1.121  1.00  0.00           C  
HETATM    4  C   UNL     1       3.596   0.617  -0.565  1.00  0.00           C  
HETATM    5  C   UNL     1       3.241  -0.748   0.029  1.00  0.00           C  
HETATM    6  C   UNL     1       1.924  -1.214  -0.534  1.00  0.00           C  
HETATM    7  C   UNL     1       6.462   2.887   0.379  1.00  0.00           C  
HETATM    8  O   UNL     1       1.901  -1.912  -1.525  1.00  0.00           O  
HETATM    9  N   UNL     1       4.290  -1.718  -0.312  1.00  0.00           N  
HETATM   10  C   UNL     1       4.342  -2.806   0.673  1.00  0.00           C  
HETATM   11  C   UNL     1       2.428   1.583  -0.358  1.00  0.00           C  
HETATM   12  C   UNL     1       3.874   0.465  -2.062  1.00  0.00           C  
HETATM   13  C   UNL     1       7.075   2.156   1.380  1.00  0.00           C  
HETATM   14  C   UNL     1       6.562   0.927   1.750  1.00  0.00           C  
HETATM   15  N   UNL     1       0.770  -0.854   0.063  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.511  -1.306  -0.484  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.834  -2.699   0.060  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.230  -3.117  -0.406  1.00  0.00           C  
HETATM   19  C   UNL     1       0.198  -3.702  -0.459  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.794  -2.671   1.589  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.598  -0.344  -0.081  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.578   0.167   1.019  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.596   0.955  -0.586  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.628  -0.066   2.605  1.00  0.00           O  
HETATM   25  C   UNL     1      -5.072   0.738   1.809  1.00  0.00           C  
HETATM   26  O   UNL     1      -5.018   2.057   2.081  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.668   0.272   0.549  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.078  -0.261   0.534  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.963   0.320  -0.579  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.566   2.089  -1.612  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.615   3.140  -1.241  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.179   2.734  -1.620  1.00  0.00           C  
HETATM   33  N   UNL     1      -2.593  -0.051  -0.941  1.00  0.00           N  
HETATM   34  C   UNL     1      -2.671  -0.740  -2.232  1.00  0.00           C  
HETATM   35  H   UNL     1       4.860   2.958  -1.035  1.00  0.00           H  
HETATM   36  H   UNL     1       5.036  -0.531   1.412  1.00  0.00           H  
HETATM   37  H   UNL     1       3.164  -0.663   1.113  1.00  0.00           H  
HETATM   38  H   UNL     1       6.862   3.847   0.089  1.00  0.00           H  
HETATM   39  H   UNL     1       5.188  -1.265  -0.398  1.00  0.00           H  
HETATM   40  H   UNL     1       3.418  -3.383   0.627  1.00  0.00           H  
HETATM   41  H   UNL     1       5.188  -3.457   0.452  1.00  0.00           H  
HETATM   42  H   UNL     1       4.458  -2.386   1.672  1.00  0.00           H  
HETATM   43  H   UNL     1       1.540   1.190  -0.854  1.00  0.00           H  
HETATM   44  H   UNL     1       2.230   1.691   0.708  1.00  0.00           H  
HETATM   45  H   UNL     1       2.680   2.555  -0.781  1.00  0.00           H  
HETATM   46  H   UNL     1       4.049   1.447  -2.500  1.00  0.00           H  
HETATM   47  H   UNL     1       4.755  -0.160  -2.207  1.00  0.00           H  
HETATM   48  H   UNL     1       3.015  -0.001  -2.545  1.00  0.00           H  
HETATM   49  H   UNL     1       7.954   2.545   1.871  1.00  0.00           H  
HETATM   50  H   UNL     1       7.041   0.356   2.533  1.00  0.00           H  
HETATM   51  H   UNL     1       0.789  -0.295   0.856  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.447  -1.347  -1.572  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.245  -3.184  -1.494  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.480  -4.089   0.020  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.960  -2.378  -0.077  1.00  0.00           H  
HETATM   56  H   UNL     1       0.170  -3.722  -1.548  1.00  0.00           H  
HETATM   57  H   UNL     1       1.193  -3.404  -0.127  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.032  -4.694  -0.071  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.025  -3.663   1.977  1.00  0.00           H  
HETATM   60  H   UNL     1       0.200  -2.373   1.921  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.530  -1.957   1.959  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.376   1.354   0.404  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.617   2.315   2.922  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.774   0.557   0.349  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.176  -1.007  -0.255  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.303  -0.719   1.497  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.371  -0.095  -1.489  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.787   1.690  -2.602  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.394   3.540  -0.251  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.593   3.949  -1.972  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.603   2.681  -1.236  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.432   1.985  -1.884  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.157   3.542  -2.351  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.958   3.133  -0.630  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.189  -1.690  -2.107  1.00  0.00           H  
HETATM   76  H   UNL     1      -3.216  -0.119  -2.943  1.00  0.00           H  
HETATM   77  H   UNL     1      -1.664  -0.922  -2.608  1.00  0.00           H  
CONECT    1    2    2    7   35                                       
CONECT    2    4    1    1    3                                       
CONECT    3    2   14   14   36                                       
CONECT    4    5   11   12    2                                       
CONECT    5    6    9    4   37                                       
CONECT    6   15    8    8    5                                       
CONECT    7    1   13   13   38                                       
CONECT    8    6    6                                                 
CONECT    9   10    5   39                                            
CONECT   10    9   40   41   42                                       
CONECT   11    4   43   44   45                                       
CONECT   12    4   46   47   48                                       
CONECT   13    7    7   14   49                                       
CONECT   14    3    3   13   50                                       
CONECT   15   16    6   51                                            
CONECT   16   17   21   15   52                                       
CONECT   17   20   19   18   16                                       
CONECT   18   17   53   54   55                                       
CONECT   19   17   56   57   58                                       
CONECT   20   17   59   60   61                                       
CONECT   21   16   33   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   33   29   30   62                                       
CONECT   24   25   25                                                 
CONECT   25   24   24   26   27                                       
CONECT   26   25   63                                                 
CONECT   27   25   28   29   29                                       
CONECT   28   27   64   65   66                                       
CONECT   29   27   27   23   67                                       
CONECT   30   23   31   32   68                                       
CONECT   31   30   69   70   71                                       
CONECT   32   30   72   73   74                                       
CONECT   33   34   21   23                                            
CONECT   34   33   75   76   77                                       
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   20                                                      
CONECT   62   23                                                      
CONECT   63   26                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
CONECT   71   31                                                      
CONECT   72   32                                                      
CONECT   73   32                                                      
CONECT   74   32                                                      
CONECT   75   34                                                      
CONECT   76   34                                                      
CONECT   77   34                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
