COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.974  -1.322  -0.013  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.337   1.346  -0.110  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.397   0.478   0.251  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.986  -3.373   0.428  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.612  -4.525   1.385  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.096  -5.686   0.663  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.867  -5.371  -0.100  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.072  -6.582  -0.343  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.211  -4.721  -1.342  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.184  -3.186  -1.231  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.778  -2.691   0.033  1.00  0.00           N  
HETATM   12  N   UNL     1      -0.954  -0.543  -0.362  1.00  0.00           N  
HETATM   13  N   UNL     1      -3.167  -0.844   0.285  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.651   1.017   0.563  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.836   2.381   0.514  1.00  0.00           C  
HETATM   16  O   UNL     1      -6.052   2.906   0.816  1.00  0.00           O  
HETATM   17  C   UNL     1      -7.085   1.986   1.174  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.782   3.233   0.156  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.989   4.577   0.114  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.876   5.393  -0.258  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.551   2.730  -0.152  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.080   0.775  -0.425  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.012   1.571  -0.783  1.00  0.00           N  
HETATM   24  C   UNL     1       1.281   0.960  -1.105  1.00  0.00           C  
HETATM   25  C   UNL     1       2.070   1.892  -2.030  1.00  0.00           C  
HETATM   26  C   UNL     1       3.442   1.277  -2.314  1.00  0.00           C  
HETATM   27  C   UNL     1       2.077   0.738   0.183  1.00  0.00           C  
HETATM   28  C   UNL     1       3.449   0.157  -0.165  1.00  0.00           C  
HETATM   29  N   UNL     1       4.165   1.085  -1.050  1.00  0.00           N  
HETATM   30  C   UNL     1       5.539   0.626  -1.294  1.00  0.00           C  
HETATM   31  C   UNL     1       6.321   0.675  -0.006  1.00  0.00           C  
HETATM   32  C   UNL     1       6.347  -0.426   0.829  1.00  0.00           C  
HETATM   33  C   UNL     1       7.064  -0.382   2.010  1.00  0.00           C  
HETATM   34  C   UNL     1       7.755   0.765   2.355  1.00  0.00           C  
HETATM   35  C   UNL     1       7.729   1.866   1.520  1.00  0.00           C  
HETATM   36  C   UNL     1       7.016   1.819   0.337  1.00  0.00           C  
HETATM   37  H   UNL     1      -3.483  -3.777  -0.454  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.650  -2.675   0.938  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.851  -4.174   2.082  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.497  -4.821   1.947  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.874  -6.478   1.379  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.861  -6.041  -0.028  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.665  -7.297  -0.914  1.00  0.00           H  
HETATM   44  H   UNL     1       0.824  -6.322  -0.906  1.00  0.00           H  
HETATM   45  H   UNL     1       0.213  -7.027   0.610  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.503  -5.031  -2.110  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.212  -5.035  -1.639  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.150  -2.847  -1.290  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.739  -2.763  -2.069  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.468   0.367   0.839  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.781   1.423   2.057  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.001   2.534   1.390  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.260   1.297   0.347  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.176   6.441  -0.251  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.062   5.244   0.452  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.541   5.117  -1.258  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.745   3.395  -0.426  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.116   2.534  -0.822  1.00  0.00           H  
HETATM   59  H   UNL     1       1.118   0.005  -1.604  1.00  0.00           H  
HETATM   60  H   UNL     1       1.528   2.020  -2.966  1.00  0.00           H  
HETATM   61  H   UNL     1       2.197   2.861  -1.547  1.00  0.00           H  
HETATM   62  H   UNL     1       3.314   0.315  -2.809  1.00  0.00           H  
HETATM   63  H   UNL     1       4.012   1.945  -2.960  1.00  0.00           H  
HETATM   64  H   UNL     1       2.205   1.689   0.701  1.00  0.00           H  
HETATM   65  H   UNL     1       1.540   0.042   0.827  1.00  0.00           H  
HETATM   66  H   UNL     1       4.024   0.011   0.749  1.00  0.00           H  
HETATM   67  H   UNL     1       3.321  -0.800  -0.670  1.00  0.00           H  
HETATM   68  H   UNL     1       5.519  -0.397  -1.668  1.00  0.00           H  
HETATM   69  H   UNL     1       6.013   1.274  -2.031  1.00  0.00           H  
HETATM   70  H   UNL     1       5.807  -1.322   0.558  1.00  0.00           H  
HETATM   71  H   UNL     1       7.084  -1.242   2.662  1.00  0.00           H  
HETATM   72  H   UNL     1       8.315   0.800   3.279  1.00  0.00           H  
HETATM   73  H   UNL     1       8.269   2.761   1.791  1.00  0.00           H  
HETATM   74  H   UNL     1       6.999   2.678  -0.317  1.00  0.00           H  
CONECT    1   11   12   12   13                                       
CONECT    2    3   21   22   22                                       
CONECT    3    2   13   13   14                                       
CONECT    4    5   11   37   38                                       
CONECT    5    4    6   39   40                                       
CONECT    6    5    7   41   42                                       
CONECT    7    6    8    9                                            
CONECT    8    7   43   44   45                                       
CONECT    9    7   10   46   47                                       
CONECT   10    9   11   48   49                                       
CONECT   11    1    4   10                                            
CONECT   12    1    1   22                                            
CONECT   13    1    3    3                                            
CONECT   14    3   15   15   50                                       
CONECT   15   14   14   16   18                                       
CONECT   16   15   17                                                 
CONECT   17   16   51   52   53                                       
CONECT   18   15   19   21   21                                       
CONECT   19   18   20                                                 
CONECT   20   19   54   55   56                                       
CONECT   21    2   18   18   57                                       
CONECT   22    2    2   12   23                                       
CONECT   23   22   24   58                                            
CONECT   24   23   25   27   59                                       
CONECT   25   24   26   60   61                                       
CONECT   26   25   29   62   63                                       
CONECT   27   24   28   64   65                                       
CONECT   28   27   29   66   67                                       
CONECT   29   26   28   30                                            
CONECT   30   29   31   68   69                                       
CONECT   31   30   32   32   36                                       
CONECT   32   31   31   33   70                                       
CONECT   33   32   34   34   71                                       
CONECT   34   33   33   35   72                                       
CONECT   35   34   36   36   73                                       
CONECT   36   31   35   35   74                                       
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   14                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
CONECT   70   32                                                      
CONECT   71   33                                                      
CONECT   72   34                                                      
CONECT   73   35                                                      
CONECT   74   36                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
