COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       7.665  -1.998  -0.074  1.00  0.00           C  
HETATM    2  O   UNL     1       6.295  -2.384   0.060  1.00  0.00           O  
HETATM    3  C   UNL     1       5.367  -1.393   0.004  1.00  0.00           C  
HETATM    4  C   UNL     1       5.771  -0.102  -0.180  1.00  0.00           C  
HETATM    5  C   UNL     1       4.006  -1.713   0.130  1.00  0.00           C  
HETATM    6  O   UNL     1       3.633  -3.007   0.306  1.00  0.00           O  
HETATM    7  C   UNL     1       2.234  -3.268   0.428  1.00  0.00           C  
HETATM    8  C   UNL     1       3.053  -0.735   0.077  1.00  0.00           C  
HETATM    9  C   UNL     1       3.440   0.596  -0.104  1.00  0.00           C  
HETATM   10  C   UNL     1       4.814   0.924  -0.238  1.00  0.00           C  
HETATM   11  N   UNL     1       5.165   2.201  -0.417  1.00  0.00           N  
HETATM   12  N   UNL     1       4.294   3.142  -0.471  1.00  0.00           N  
HETATM   13  C   UNL     1       2.991   2.938  -0.357  1.00  0.00           C  
HETATM   14  C   UNL     1       2.495   1.653  -0.167  1.00  0.00           C  
HETATM   15  C   UNL     1       1.043   1.397  -0.042  1.00  0.00           C  
HETATM   16  C   UNL     1       0.264   2.146   0.850  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.086   1.872   0.932  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.966   2.650   1.876  1.00  0.00           C  
HETATM   19  C   UNL     1       0.429   0.413  -0.815  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.863   0.182  -0.706  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.627   0.868   0.132  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.984   0.587   0.208  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.211  -0.794   0.653  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.708  -1.023   0.866  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.649   0.847  -1.074  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.160   0.667  -0.913  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.452  -0.762  -0.447  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.956  -0.930  -0.225  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.430   0.066   0.836  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.697  -0.669  -1.538  1.00  0.00           C  
HETATM   31  O   UNL     1      -7.226  -2.262   0.217  1.00  0.00           O  
HETATM   32  H   UNL     1       7.927  -1.305   0.725  1.00  0.00           H  
HETATM   33  H   UNL     1       8.299  -2.882  -0.012  1.00  0.00           H  
HETATM   34  H   UNL     1       7.812  -1.512  -1.039  1.00  0.00           H  
HETATM   35  H   UNL     1       6.821   0.129  -0.279  1.00  0.00           H  
HETATM   36  H   UNL     1       2.074  -4.338   0.564  1.00  0.00           H  
HETATM   37  H   UNL     1       1.837  -2.729   1.288  1.00  0.00           H  
HETATM   38  H   UNL     1       1.722  -2.937  -0.476  1.00  0.00           H  
HETATM   39  H   UNL     1       2.007  -0.989   0.175  1.00  0.00           H  
HETATM   40  H   UNL     1       2.310   3.773  -0.412  1.00  0.00           H  
HETATM   41  H   UNL     1       0.709   2.919   1.459  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.436   3.474   1.339  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.737   1.993   2.280  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.362   3.046   2.693  1.00  0.00           H  
HETATM   45  H   UNL     1       1.020  -0.167  -1.509  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.842  -1.485  -0.105  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.680  -0.966   1.590  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.878  -2.053   1.181  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.075  -0.342   1.634  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.437   1.868  -1.393  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.278   0.149  -1.824  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.534   1.375  -0.173  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.652   0.846  -1.869  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.113  -1.469  -1.204  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.224   1.081   0.498  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.502  -0.054   0.993  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.902  -0.121   1.771  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.360  -1.378  -2.293  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.769  -0.788  -1.380  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.491   0.347  -1.875  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.163  -2.440   0.378  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    1    3                                                 
CONECT    3    4    2    5    5                                       
CONECT    4   10   10    3   35                                       
CONECT    5    3    3    8    6                                       
CONECT    6    5    7                                                 
CONECT    7    6   36   37   38                                       
CONECT    8    9    9    5   39                                       
CONECT    9   10   14    8    8                                       
CONECT   10   11    4    4    9                                       
CONECT   11   12   12   10                                            
CONECT   12   11   11   13                                            
CONECT   13   12   14   14   40                                       
CONECT   14   13   13    9   15                                       
CONECT   15   14   19   19   16                                       
CONECT   16   15   17   17   41                                       
CONECT   17   16   16   21   18                                       
CONECT   18   17   42   43   44                                       
CONECT   19   15   15   20   45                                       
CONECT   20   19   21   21                                            
CONECT   21   20   20   17   22                                       
CONECT   22   21   23   25                                            
CONECT   23   22   24   46   47                                       
CONECT   24   23   27   48   49                                       
CONECT   25   22   26   50   51                                       
CONECT   26   25   27   52   53                                       
CONECT   27   24   26   28   54                                       
CONECT   28   27   31   30   29                                       
CONECT   29   28   55   56   57                                       
CONECT   30   28   58   59   60                                       
CONECT   31   28   61                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
