COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.066  -0.914   1.238  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.062  -0.652   0.059  1.00  0.00           C  
HETATM    3  O   UNL     1      -8.203  -0.713  -0.646  1.00  0.00           O  
HETATM    4  C   UNL     1      -5.778  -0.251  -0.620  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.639  -0.255   0.401  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.335   0.152  -0.288  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.442   1.600  -0.769  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.175   0.028   0.702  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.129  -1.396   1.288  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.749  -1.985   0.933  1.00  0.00           C  
HETATM   11  C   UNL     1       0.125  -0.769   0.586  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.838   0.243  -0.022  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.007  -0.031  -1.518  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.319   1.591   0.191  1.00  0.00           N  
HETATM   15  N   UNL     1      -0.794   2.568   0.866  1.00  0.00           N  
HETATM   16  N   UNL     1       0.020   3.566   0.768  1.00  0.00           N  
HETATM   17  N   UNL     1       1.023   3.232   0.025  1.00  0.00           N  
HETATM   18  C   UNL     1       0.843   1.998  -0.356  1.00  0.00           C  
HETATM   19  C   UNL     1       1.721   1.146  -1.232  1.00  0.00           C  
HETATM   20  C   UNL     1       2.321  -0.006  -0.400  1.00  0.00           C  
HETATM   21  C   UNL     1       1.305  -1.140  -0.278  1.00  0.00           C  
HETATM   22  C   UNL     1       1.961  -2.379   0.347  1.00  0.00           C  
HETATM   23  C   UNL     1       3.170  -2.822  -0.470  1.00  0.00           C  
HETATM   24  C   UNL     1       4.196  -1.686  -0.479  1.00  0.00           C  
HETATM   25  C   UNL     1       4.581  -1.325   0.957  1.00  0.00           C  
HETATM   26  C   UNL     1       5.593  -0.178   0.937  1.00  0.00           C  
HETATM   27  O   UNL     1       5.949   0.166   2.277  1.00  0.00           O  
HETATM   28  C   UNL     1       4.976   1.039   0.245  1.00  0.00           C  
HETATM   29  C   UNL     1       4.589   0.672  -1.189  1.00  0.00           C  
HETATM   30  C   UNL     1       3.569  -0.472  -1.161  1.00  0.00           C  
HETATM   31  C   UNL     1       3.184  -0.838  -2.595  1.00  0.00           C  
HETATM   32  H   UNL     1      -9.002  -0.971  -0.167  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.552  -0.959  -1.418  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.885   0.748  -1.041  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.864   0.452   1.199  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.531  -1.255   0.822  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.155  -0.502  -1.141  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.189   1.666  -1.560  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.738   2.239   0.064  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.476   1.928  -1.153  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.287   0.759   1.503  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.249  -1.356   2.371  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.920  -2.004   0.849  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.334  -2.519   1.788  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.831  -2.651   0.073  1.00  0.00           H  
HETATM   46  H   UNL     1       0.512  -0.353   1.516  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.640  -0.908  -1.657  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.472   0.831  -1.995  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.031  -0.212  -1.967  1.00  0.00           H  
HETATM   50  H   UNL     1       1.128   0.734  -2.049  1.00  0.00           H  
HETATM   51  H   UNL     1       2.526   1.756  -1.641  1.00  0.00           H  
HETATM   52  H   UNL     1       2.602   0.358   0.588  1.00  0.00           H  
HETATM   53  H   UNL     1       0.947  -1.403  -1.273  1.00  0.00           H  
HETATM   54  H   UNL     1       2.280  -2.143   1.362  1.00  0.00           H  
HETATM   55  H   UNL     1       1.234  -3.191   0.379  1.00  0.00           H  
HETATM   56  H   UNL     1       3.612  -3.710  -0.017  1.00  0.00           H  
HETATM   57  H   UNL     1       2.861  -3.045  -1.491  1.00  0.00           H  
HETATM   58  H   UNL     1       5.082  -1.998  -1.033  1.00  0.00           H  
HETATM   59  H   UNL     1       3.691  -1.016   1.505  1.00  0.00           H  
HETATM   60  H   UNL     1       5.025  -2.194   1.444  1.00  0.00           H  
HETATM   61  H   UNL     1       6.485  -0.490   0.394  1.00  0.00           H  
HETATM   62  H   UNL     1       6.589   0.888   2.341  1.00  0.00           H  
HETATM   63  H   UNL     1       4.087   1.355   0.791  1.00  0.00           H  
HETATM   64  H   UNL     1       5.700   1.854   0.229  1.00  0.00           H  
HETATM   65  H   UNL     1       4.149   1.540  -1.681  1.00  0.00           H  
HETATM   66  H   UNL     1       5.477   0.355  -1.736  1.00  0.00           H  
HETATM   67  H   UNL     1       2.467  -1.659  -2.581  1.00  0.00           H  
HETATM   68  H   UNL     1       2.735   0.027  -3.083  1.00  0.00           H  
HETATM   69  H   UNL     1       4.075  -1.144  -3.144  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   32                                                 
CONECT    4    2    5   33   34                                       
CONECT    5    4    6   35   36                                       
CONECT    6    5    8    7   37                                       
CONECT    7    6   38   39   40                                       
CONECT    8    9   12    6   41                                       
CONECT    9   10    8   42   43                                       
CONECT   10    9   11   44   45                                       
CONECT   11   10   21   12   46                                       
CONECT   12   13   11    8   14                                       
CONECT   13   12   47   48   49                                       
CONECT   14   12   18   15                                            
CONECT   15   14   16   16                                            
CONECT   16   15   15   17                                            
CONECT   17   18   18   16                                            
CONECT   18   19   14   17   17                                       
CONECT   19   20   18   50   51                                       
CONECT   20   21   30   19   52                                       
CONECT   21   22   11   20   53                                       
CONECT   22   23   21   54   55                                       
CONECT   23   22   24   56   57                                       
CONECT   24   23   30   25   58                                       
CONECT   25   24   26   59   60                                       
CONECT   26   25   28   27   61                                       
CONECT   27   26   62                                                 
CONECT   28   29   26   63   64                                       
CONECT   29   30   28   65   66                                       
CONECT   30   31   24   20   29                                       
CONECT   31   30   67   68   69                                       
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   29                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
