COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.353   1.052  11.417  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.224   0.330  11.497  1.00  0.00           N  
HETATM    3  C   UNL     1       0.324  -0.263  10.396  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.275  -0.145   9.195  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.461   0.606   9.078  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.001   1.198  10.178  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.818   1.575  12.417  1.00  0.00           O  
HETATM    8  C   UNL     1       1.608  -1.028  10.594  1.00  0.00           C  
HETATM    9  C   UNL     1       0.259  -0.793   7.944  1.00  0.00           C  
HETATM   10  C   UNL     1       1.725  -1.179   8.121  1.00  0.00           C  
HETATM   11  C   UNL     1       1.858  -1.977   9.425  1.00  0.00           C  
HETATM   12  N   UNL     1       0.139   0.146   6.822  1.00  0.00           N  
HETATM   13  C   UNL     1       0.166  -0.656   5.593  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.504  -0.981 -11.333  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.351  -0.310 -11.479  1.00  0.00           N  
HETATM   16  C   UNL     1       0.284   0.258 -10.412  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.247   0.162  -9.178  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.456  -0.538  -8.992  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.082  -1.107 -10.058  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.050  -1.481 -12.304  1.00  0.00           O  
HETATM   21  C   UNL     1       1.579   0.979 -10.687  1.00  0.00           C  
HETATM   22  C   UNL     1       0.389   0.777  -7.959  1.00  0.00           C  
HETATM   23  C   UNL     1       1.856   1.106  -8.226  1.00  0.00           C  
HETATM   24  C   UNL     1       1.937   1.909  -9.530  1.00  0.00           C  
HETATM   25  N   UNL     1       0.301  -0.168  -6.838  1.00  0.00           N  
HETATM   26  C   UNL     1       0.274   0.635  -5.609  1.00  0.00           C  
HETATM   27  C   UNL     1       0.165   0.271   4.377  1.00  0.00           C  
HETATM   28  C   UNL     1       0.193  -0.565   3.096  1.00  0.00           C  
HETATM   29  C   UNL     1       0.192   0.362   1.880  1.00  0.00           C  
HETATM   30  C   UNL     1       0.220  -0.474   0.600  1.00  0.00           C  
HETATM   31  C   UNL     1       0.219   0.453  -0.616  1.00  0.00           C  
HETATM   32  C   UNL     1       0.248  -0.384  -1.896  1.00  0.00           C  
HETATM   33  C   UNL     1       0.247   0.544  -3.112  1.00  0.00           C  
HETATM   34  C   UNL     1       0.275  -0.293  -4.393  1.00  0.00           C  
HETATM   35  H   UNL     1       0.212   0.228  12.357  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.944   0.709   8.117  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.909   1.778  10.099  1.00  0.00           H  
HETATM   38  H   UNL     1       2.437  -0.324  10.669  1.00  0.00           H  
HETATM   39  H   UNL     1       1.543  -1.604  11.517  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.324  -1.688   7.727  1.00  0.00           H  
HETATM   41  H   UNL     1       2.048  -1.793   7.280  1.00  0.00           H  
HETATM   42  H   UNL     1       2.338  -0.280   8.177  1.00  0.00           H  
HETATM   43  H   UNL     1       1.122  -2.781   9.440  1.00  0.00           H  
HETATM   44  H   UNL     1       2.861  -2.395   9.499  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.782   0.553   6.883  1.00  0.00           H  
HETATM   46  H   UNL     1       1.066  -1.271   5.581  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.713  -1.299   5.560  1.00  0.00           H  
HETATM   48  H   UNL     1       0.039  -0.226 -12.363  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.885  -0.623  -8.005  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.007  -1.648  -9.926  1.00  0.00           H  
HETATM   51  H   UNL     1       1.477   1.564 -11.600  1.00  0.00           H  
HETATM   52  H   UNL     1       2.376   0.246 -10.818  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.143   1.692  -7.699  1.00  0.00           H  
HETATM   54  H   UNL     1       2.255   1.700  -7.403  1.00  0.00           H  
HETATM   55  H   UNL     1       2.428   0.184  -8.325  1.00  0.00           H  
HETATM   56  H   UNL     1       1.232   2.739  -9.495  1.00  0.00           H  
HETATM   57  H   UNL     1       2.949   2.291  -9.665  1.00  0.00           H  
HETATM   58  H   UNL     1       1.167  -0.686  -6.827  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.625   1.249  -5.596  1.00  0.00           H  
HETATM   60  H   UNL     1       1.154   1.278  -5.576  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.734   0.885   4.389  1.00  0.00           H  
HETATM   62  H   UNL     1       1.044   0.914   4.410  1.00  0.00           H  
HETATM   63  H   UNL     1       1.093  -1.180   3.084  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.686  -1.208   3.063  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.707   0.976   1.893  1.00  0.00           H  
HETATM   66  H   UNL     1       1.072   1.005   1.913  1.00  0.00           H  
HETATM   67  H   UNL     1       1.120  -1.089   0.587  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.658  -1.117   0.567  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.680   1.067  -0.603  1.00  0.00           H  
HETATM   70  H   UNL     1       1.099   1.096  -0.583  1.00  0.00           H  
HETATM   71  H   UNL     1       1.148  -0.998  -1.909  1.00  0.00           H  
HETATM   72  H   UNL     1      -0.631  -1.026  -1.929  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.652   1.158  -3.100  1.00  0.00           H  
HETATM   74  H   UNL     1       1.126   1.187  -3.079  1.00  0.00           H  
HETATM   75  H   UNL     1       1.175  -0.907  -4.405  1.00  0.00           H  
HETATM   76  H   UNL     1      -0.604  -0.935  -4.426  1.00  0.00           H  
CONECT    1    2    6    7    7                                       
CONECT    2    1    3   35                                            
CONECT    3    2    4    4    8                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4    6    6   36                                       
CONECT    6    1    5    5   37                                       
CONECT    7    1    1                                                 
CONECT    8    3   11   38   39                                       
CONECT    9    4   10   12   40                                       
CONECT   10    9   11   41   42                                       
CONECT   11    8   10   43   44                                       
CONECT   12    9   13   45                                            
CONECT   13   12   27   46   47                                       
CONECT   14   15   19   20   20                                       
CONECT   15   14   16   48                                            
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   22                                       
CONECT   18   17   19   19   49                                       
CONECT   19   14   18   18   50                                       
CONECT   20   14   14                                                 
CONECT   21   16   24   51   52                                       
CONECT   22   17   23   25   53                                       
CONECT   23   22   24   54   55                                       
CONECT   24   21   23   56   57                                       
CONECT   25   22   26   58                                            
CONECT   26   25   34   59   60                                       
CONECT   27   13   28   61   62                                       
CONECT   28   27   29   63   64                                       
CONECT   29   28   30   65   66                                       
CONECT   30   29   31   67   68                                       
CONECT   31   30   32   69   70                                       
CONECT   32   31   33   71   72                                       
CONECT   33   32   34   73   74                                       
CONECT   34   26   33   75   76                                       
CONECT   35    2                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   30                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
CONECT   74   33                                                      
CONECT   75   34                                                      
CONECT   76   34                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
