COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.241   1.387   0.393  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.792   0.017   0.095  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.076  -1.163   0.031  1.00  0.00           C  
HETATM    4  N   UNL     1      -3.747   4.561  -1.539  1.00  0.00           N  
HETATM    5  C   UNL     1       0.357   0.166   1.461  1.00  0.00           C  
HETATM    6  C   UNL     1       1.847  -0.175   1.516  1.00  0.00           C  
HETATM    7  C   UNL     1       2.440  -0.098   0.107  1.00  0.00           C  
HETATM    8  C   UNL     1       1.722  -1.097  -0.803  1.00  0.00           C  
HETATM    9  C   UNL     1       0.231  -0.757  -0.858  1.00  0.00           C  
HETATM   10  C   UNL     1       4.577   0.450   1.104  1.00  0.00           C  
HETATM   11  C   UNL     1       6.021  -0.036   1.266  1.00  0.00           C  
HETATM   12  C   UNL     1       5.915  -0.882  -1.110  1.00  0.00           C  
HETATM   13  C   UNL     1       4.475  -0.362  -1.178  1.00  0.00           C  
HETATM   14  C   UNL     1       7.821   0.448  -0.328  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.125  -0.306  -0.164  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.396   2.279  -0.841  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.736   3.609  -0.586  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.194   3.823   0.478  1.00  0.00           O  
HETATM   19  C   UNL     1      -5.008   2.001   1.566  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.197  -1.645  -0.381  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.966  -2.177  -0.267  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.470  -3.483  -0.386  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.198  -3.717  -0.216  1.00  0.00           C  
HETATM   24  N   UNL     1      -2.328  -2.749   0.071  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.711  -1.490   0.201  1.00  0.00           C  
HETATM   26  N   UNL     1      -1.789  -0.507   0.499  1.00  0.00           N  
HETATM   27  C   UNL     1      -0.361  -0.833   0.551  1.00  0.00           C  
HETATM   28  N   UNL     1       3.871  -0.426   0.159  1.00  0.00           N  
HETATM   29  N   UNL     1       6.633  -0.133  -0.068  1.00  0.00           N  
HETATM   30  C   UNL     1       8.540   1.211   0.755  1.00  0.00           C  
HETATM   31  O   UNL     1       8.312   0.357  -1.433  1.00  0.00           O  
HETATM   32  H   UNL     1      -3.185   1.306   0.652  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.322   5.418  -1.375  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.180   4.390  -2.390  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.065   0.112   2.465  1.00  0.00           H  
HETATM   36  H   UNL     1       0.229   1.174   1.067  1.00  0.00           H  
HETATM   37  H   UNL     1       2.359   0.537   2.164  1.00  0.00           H  
HETATM   38  H   UNL     1       1.976  -1.183   1.910  1.00  0.00           H  
HETATM   39  H   UNL     1       2.312   0.910  -0.287  1.00  0.00           H  
HETATM   40  H   UNL     1       2.144  -1.043  -1.806  1.00  0.00           H  
HETATM   41  H   UNL     1       1.850  -2.105  -0.409  1.00  0.00           H  
HETATM   42  H   UNL     1       0.103   0.252  -1.252  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.281  -1.468  -1.506  1.00  0.00           H  
HETATM   44  H   UNL     1       4.074   0.423   2.071  1.00  0.00           H  
HETATM   45  H   UNL     1       4.577   1.471   0.723  1.00  0.00           H  
HETATM   46  H   UNL     1       6.581   0.674   1.875  1.00  0.00           H  
HETATM   47  H   UNL     1       6.027  -1.014   1.747  1.00  0.00           H  
HETATM   48  H   UNL     1       5.910  -1.944  -0.861  1.00  0.00           H  
HETATM   49  H   UNL     1       6.405  -0.732  -2.072  1.00  0.00           H  
HETATM   50  H   UNL     1       4.477   0.670  -1.528  1.00  0.00           H  
HETATM   51  H   UNL     1       3.898  -0.979  -1.867  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.953   0.387  -0.187  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.925   1.798  -1.698  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.456   2.432  -1.047  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.063   2.083   1.307  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.897   1.366   2.445  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.609   2.993   1.781  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.098  -2.196  -0.607  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.837  -4.730  -0.312  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.086   0.400   0.674  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.233  -1.841   0.945  1.00  0.00           H  
HETATM   62  H   UNL     1       8.751   0.544   1.591  1.00  0.00           H  
HETATM   63  H   UNL     1       9.476   1.606   0.361  1.00  0.00           H  
HETATM   64  H   UNL     1       7.913   2.034   1.097  1.00  0.00           H  
CONECT    1   16   19    2   32                                       
CONECT    2    1    3    3   15                                       
CONECT    3    2    2   25   21                                       
CONECT    4   17   33   34                                            
CONECT    5    6   27   35   36                                       
CONECT    6    7    5   37   38                                       
CONECT    7   28    6    8   39                                       
CONECT    8    7    9   40   41                                       
CONECT    9    8   27   42   43                                       
CONECT   10   28   11   44   45                                       
CONECT   11   29   10   46   47                                       
CONECT   12   13   29   48   49                                       
CONECT   13   12   28   50   51                                       
CONECT   14   30   29   31   31                                       
CONECT   15    2   20   20   52                                       
CONECT   16   17    1   53   54                                       
CONECT   17    4   18   18   16                                       
CONECT   18   17   17                                                 
CONECT   19    1   55   56   57                                       
CONECT   20   15   15   21   58                                       
CONECT   21    3   20   22                                            
CONECT   22   21   23   23                                            
CONECT   23   24   22   22   59                                       
CONECT   24   25   25   23                                            
CONECT   25   26    3   24   24                                       
CONECT   26   27   25   60                                            
CONECT   27    5    9   26   61                                       
CONECT   28   13    7   10                                            
CONECT   29   12   14   11                                            
CONECT   30   14   62   63   64                                       
CONECT   31   14   14                                                 
CONECT   32    1                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   23                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
