COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.613  -4.407  -0.897  1.00  0.00           O  
HETATM    2  C   UNL     1       1.829  -4.459  -1.050  1.00  0.00           C  
HETATM    3  C   UNL     1       2.509  -5.661  -1.697  1.00  0.00           C  
HETATM    4  N   UNL     1       2.778  -3.511  -0.683  1.00  0.00           N  
HETATM    5  C   UNL     1       2.518  -2.284  -0.064  1.00  0.00           C  
HETATM    6  C   UNL     1       1.290  -1.686  -0.352  1.00  0.00           C  
HETATM    7  C   UNL     1       0.956  -0.463   0.226  1.00  0.00           C  
HETATM    8  C   UNL     1       3.416  -1.654   0.806  1.00  0.00           C  
HETATM    9  C   UNL     1       3.081  -0.428   1.384  1.00  0.00           C  
HETATM   10  C   UNL     1       1.848   0.168   1.093  1.00  0.00           C  
HETATM   11  C   UNL     1       4.019   0.248   2.304  1.00  0.00           C  
HETATM   12  O   UNL     1       3.692   1.323   2.791  1.00  0.00           O  
HETATM   13  C   UNL     1       5.317  -0.392   2.602  1.00  0.00           C  
HETATM   14  C   UNL     1       5.652  -1.618   2.024  1.00  0.00           C  
HETATM   15  C   UNL     1       6.885  -2.214   2.315  1.00  0.00           C  
HETATM   16  C   UNL     1       4.713  -2.294   1.104  1.00  0.00           C  
HETATM   17  O   UNL     1       5.042  -3.367   0.615  1.00  0.00           O  
HETATM   18  C   UNL     1       6.215   0.238   3.472  1.00  0.00           C  
HETATM   19  N   UNL     1       5.955   1.465   4.091  1.00  0.00           N  
HETATM   20  C   UNL     1       7.443  -0.359   3.759  1.00  0.00           C  
HETATM   21  C   UNL     1       7.777  -1.583   3.182  1.00  0.00           C  
HETATM   22  C   UNL     1       6.438   1.875   5.330  1.00  0.00           C  
HETATM   23  O   UNL     1       7.159   1.252   6.101  1.00  0.00           O  
HETATM   24  C   UNL     1       5.929   3.276   5.654  1.00  0.00           C  
HETATM   25  C   UNL     1       6.413   3.805   6.998  1.00  0.00           C  
HETATM   26  N   UNL     1       5.900   5.118   7.283  1.00  0.00           N  
HETATM   27  C   UNL     1       6.379   5.609   8.584  1.00  0.00           C  
HETATM   28  C   UNL     1       7.868   5.608   8.645  1.00  0.00           C  
HETATM   29  C   UNL     1       4.429   5.135   7.262  1.00  0.00           C  
HETATM   30  C   UNL     1       3.904   6.514   7.473  1.00  0.00           C  
HETATM   31  C   UNL     1       1.539  -6.752  -2.131  1.00  0.00           C  
HETATM   32  N   UNL     1       2.214  -7.878  -2.719  1.00  0.00           N  
HETATM   33  C   UNL     1       1.259  -8.919  -3.130  1.00  0.00           C  
HETATM   34  C   UNL     1       0.241  -8.373  -4.072  1.00  0.00           C  
HETATM   35  C   UNL     1       3.200  -8.455  -1.792  1.00  0.00           C  
HETATM   36  C   UNL     1       3.956  -9.567  -2.435  1.00  0.00           C  
HETATM   37  H   UNL     1       3.207  -6.078  -0.960  1.00  0.00           H  
HETATM   38  H   UNL     1       3.095  -5.312  -2.556  1.00  0.00           H  
HETATM   39  H   UNL     1       3.750  -3.730  -0.883  1.00  0.00           H  
HETATM   40  H   UNL     1       0.583  -2.164  -1.026  1.00  0.00           H  
HETATM   41  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   42  H   UNL     1       1.562   1.122   1.529  1.00  0.00           H  
HETATM   43  H   UNL     1       7.171  -3.168   1.879  1.00  0.00           H  
HETATM   44  H   UNL     1       5.357   2.118   3.590  1.00  0.00           H  
HETATM   45  H   UNL     1       8.150   0.119   4.433  1.00  0.00           H  
HETATM   46  H   UNL     1       8.733  -2.046   3.407  1.00  0.00           H  
HETATM   47  H   UNL     1       4.834   3.233   5.663  1.00  0.00           H  
HETATM   48  H   UNL     1       6.234   3.955   4.849  1.00  0.00           H  
HETATM   49  H   UNL     1       7.505   3.859   7.039  1.00  0.00           H  
HETATM   50  H   UNL     1       6.070   3.149   7.805  1.00  0.00           H  
HETATM   51  H   UNL     1       5.990   6.623   8.722  1.00  0.00           H  
HETATM   52  H   UNL     1       5.958   4.962   9.360  1.00  0.00           H  
HETATM   53  H   UNL     1       8.263   4.593   8.525  1.00  0.00           H  
HETATM   54  H   UNL     1       8.291   6.254   7.868  1.00  0.00           H  
HETATM   55  H   UNL     1       8.201   5.987   9.619  1.00  0.00           H  
HETATM   56  H   UNL     1       4.105   4.745   6.293  1.00  0.00           H  
HETATM   57  H   UNL     1       4.077   4.462   8.049  1.00  0.00           H  
HETATM   58  H   UNL     1       4.211   6.905   8.449  1.00  0.00           H  
HETATM   59  H   UNL     1       4.257   7.191   6.686  1.00  0.00           H  
HETATM   60  H   UNL     1       2.808   6.503   7.443  1.00  0.00           H  
HETATM   61  H   UNL     1       0.817  -6.379  -2.864  1.00  0.00           H  
HETATM   62  H   UNL     1       0.987  -7.130  -1.265  1.00  0.00           H  
HETATM   63  H   UNL     1       1.828  -9.724  -3.605  1.00  0.00           H  
HETATM   64  H   UNL     1       0.782  -9.309  -2.227  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.344  -7.577  -3.598  1.00  0.00           H  
HETATM   66  H   UNL     1       0.717  -7.980  -4.977  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.452  -9.168  -4.372  1.00  0.00           H  
HETATM   68  H   UNL     1       3.880  -7.654  -1.488  1.00  0.00           H  
HETATM   69  H   UNL     1       2.660  -8.812  -0.911  1.00  0.00           H  
HETATM   70  H   UNL     1       3.283 -10.380  -2.727  1.00  0.00           H  
HETATM   71  H   UNL     1       4.497  -9.211  -3.319  1.00  0.00           H  
HETATM   72  H   UNL     1       4.691  -9.973  -1.730  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   31   37   38                                       
CONECT    4    2    5   39                                            
CONECT    5    4    6    6    8                                       
CONECT    6    5    5    7   40                                       
CONECT    7    6   10   10   41                                       
CONECT    8    5    9    9   16                                       
CONECT    9    8    8   10   11                                       
CONECT   10    7    7    9   42                                       
CONECT   11    9   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   14   18                                       
CONECT   14   13   13   15   16                                       
CONECT   15   14   21   21   43                                       
CONECT   16    8   14   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   13   19   20   20                                       
CONECT   19   18   22   44                                            
CONECT   20   18   18   21   45                                       
CONECT   21   15   15   20   46                                       
CONECT   22   19   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   47   48                                       
CONECT   25   24   26   49   50                                       
CONECT   26   25   27   29                                            
CONECT   27   26   28   51   52                                       
CONECT   28   27   53   54   55                                       
CONECT   29   26   30   56   57                                       
CONECT   30   29   58   59   60                                       
CONECT   31    3   32   61   62                                       
CONECT   32   31   33   35                                            
CONECT   33   32   34   63   64                                       
CONECT   34   33   65   66   67                                       
CONECT   35   32   36   68   69                                       
CONECT   36   35   70   71   72                                       
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   15                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
CONECT   68   35                                                      
CONECT   69   35                                                      
CONECT   70   36                                                      
CONECT   71   36                                                      
CONECT   72   36                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
