COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.149  -1.021   0.892  1.00  0.00           C  
HETATM    2  C   UNL     1       3.087  -1.753   0.064  1.00  0.00           C  
HETATM    3  O   UNL     1       2.280  -0.786  -0.657  1.00  0.00           O  
HETATM    4  C   UNL     1       1.699  -1.179  -1.796  1.00  0.00           C  
HETATM    5  O   UNL     1       1.798  -2.337  -2.147  1.00  0.00           O  
HETATM    6  C   UNL     1       3.476   0.074   1.685  1.00  0.00           C  
HETATM    7  C   UNL     1       0.941  -0.217  -2.670  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.001   0.663  -1.863  1.00  0.00           C  
HETATM    9  C   UNL     1       0.677   1.881  -1.250  1.00  0.00           C  
HETATM   10  C   UNL     1       0.222   2.077   0.200  1.00  0.00           C  
HETATM   11  C   UNL     1       1.204   2.996   0.935  1.00  0.00           C  
HETATM   12  C   UNL     1       2.158   2.130   1.726  1.00  0.00           C  
HETATM   13  C   UNL     1       2.868   1.061   1.031  1.00  0.00           C  
HETATM   14  O   UNL     1       2.322   2.326   2.908  1.00  0.00           O  
HETATM   15  O   UNL     1       5.129  -0.453   0.024  1.00  0.00           O  
HETATM   16  C   UNL     1       4.816  -2.011   1.847  1.00  0.00           C  
HETATM   17  C   UNL     1       2.192  -2.569   0.999  1.00  0.00           C  
HETATM   18  C   UNL     1       0.431   3.902   1.894  1.00  0.00           C  
HETATM   19  C   UNL     1       0.274   3.130  -2.050  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.624  -0.124  -0.843  1.00  0.00           O  
HETATM   21  C   UNL     1       1.907   0.595  -3.527  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.606  -1.084   0.157  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.052  -0.126  -0.902  1.00  0.00           C  
HETATM   24  O   UNL     1      -2.542   1.193  -0.652  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.965   1.309  -0.713  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.595   0.409   0.353  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.136  -1.035   0.128  1.00  0.00           C  
HETATM   28  O   UNL     1      -2.165  -2.413  -0.124  1.00  0.00           O  
HETATM   29  N   UNL     1      -4.676  -1.893   1.191  1.00  0.00           N  
HETATM   30  C   UNL     1      -4.370   2.762  -0.459  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.433  -1.306   2.516  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.107  -2.151   0.984  1.00  0.00           C  
HETATM   33  C   UNL     1       1.222  -3.413   0.169  1.00  0.00           C  
HETATM   34  H   UNL     1       3.576  -2.420  -0.645  1.00  0.00           H  
HETATM   35  H   UNL     1       3.496   0.049   2.763  1.00  0.00           H  
HETATM   36  H   UNL     1       0.324  -0.824  -3.362  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.800   1.016  -2.537  1.00  0.00           H  
HETATM   38  H   UNL     1       1.757   1.780  -1.265  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.772   2.519   0.216  1.00  0.00           H  
HETATM   40  H   UNL     1       0.202   1.116   0.714  1.00  0.00           H  
HETATM   41  H   UNL     1       1.764   3.598   0.228  1.00  0.00           H  
HETATM   42  H   UNL     1       2.925   1.087  -0.053  1.00  0.00           H  
HETATM   43  H   UNL     1       5.832   0.025   0.484  1.00  0.00           H  
HETATM   44  H   UNL     1       5.288  -2.808   1.273  1.00  0.00           H  
HETATM   45  H   UNL     1       5.572  -1.492   2.438  1.00  0.00           H  
HETATM   46  H   UNL     1       4.065  -2.437   2.513  1.00  0.00           H  
HETATM   47  H   UNL     1       2.809  -3.225   1.613  1.00  0.00           H  
HETATM   48  H   UNL     1       1.627  -1.894   1.643  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.106   3.290   2.619  1.00  0.00           H  
HETATM   50  H   UNL     1       1.129   4.557   2.417  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.280   4.506   1.330  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.808   3.252  -2.013  1.00  0.00           H  
HETATM   53  H   UNL     1       0.754   4.008  -1.619  1.00  0.00           H  
HETATM   54  H   UNL     1       0.591   3.015  -3.087  1.00  0.00           H  
HETATM   55  H   UNL     1       2.487  -0.078  -4.158  1.00  0.00           H  
HETATM   56  H   UNL     1       1.344   1.286  -4.153  1.00  0.00           H  
HETATM   57  H   UNL     1       2.581   1.157  -2.880  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.250  -0.782   1.142  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.375  -0.453  -1.891  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.312   1.001  -1.699  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.280   0.741   1.343  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.681   0.462   0.279  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.494  -1.384  -0.841  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.223  -2.558   0.039  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.920   3.402  -1.218  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.455   2.850  -0.506  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.022   3.069   0.527  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.916  -0.331   2.575  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.842  -1.962   3.284  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.360  -1.190   2.671  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.249  -2.668   0.035  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.485  -2.772   1.796  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.648  -1.205   0.968  1.00  0.00           H  
HETATM   74  H   UNL     1       0.650  -2.763  -0.493  1.00  0.00           H  
HETATM   75  H   UNL     1       1.784  -4.133  -0.426  1.00  0.00           H  
HETATM   76  H   UNL     1       0.541  -3.944   0.835  1.00  0.00           H  
CONECT    1    2    6   15   16                                       
CONECT    2    1    3   17   34                                       
CONECT    3    2    4                                                 
CONECT    4    3    5    5    7                                       
CONECT    5    4    4                                                 
CONECT    6    1   13   13   35                                       
CONECT    7    4    8   21   36                                       
CONECT    8    7    9   20   37                                       
CONECT    9    8   10   19   38                                       
CONECT   10    9   11   39   40                                       
CONECT   11   10   12   18   41                                       
CONECT   12   11   13   14   14                                       
CONECT   13    6    6   12   42                                       
CONECT   14   12   12                                                 
CONECT   15    1   43                                                 
CONECT   16    1   44   45   46                                       
CONECT   17    2   33   47   48                                       
CONECT   18   11   49   50   51                                       
CONECT   19    9   52   53   54                                       
CONECT   20    8   23                                                 
CONECT   21    7   55   56   57                                       
CONECT   22   23   27   28   58                                       
CONECT   23   20   22   24   59                                       
CONECT   24   23   25                                                 
CONECT   25   24   26   30   60                                       
CONECT   26   25   27   61   62                                       
CONECT   27   22   26   29   63                                       
CONECT   28   22   64                                                 
CONECT   29   27   31   32                                            
CONECT   30   25   65   66   67                                       
CONECT   31   29   68   69   70                                       
CONECT   32   29   71   72   73                                       
CONECT   33   17   74   75   76                                       
CONECT   34    2                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   32                                                      
CONECT   74   33                                                      
CONECT   75   33                                                      
CONECT   76   33                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
