COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.112   0.093  -0.694  1.00  0.00           C  
HETATM    2  C   UNL     1       5.205  -0.301   0.474  1.00  0.00           C  
HETATM    3  C   UNL     1       2.834  -0.689   0.878  1.00  0.00           C  
HETATM    4  C   UNL     1       1.125  -0.465  -0.917  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.892  -1.146   0.871  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.747  -3.163   0.179  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.622  -2.978  -2.308  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.219   0.129  -1.214  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.571   1.482  -0.011  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.431   3.764   0.530  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.338   2.562  -1.463  1.00  0.00           C  
HETATM   12  C   UNL     1       8.644   0.419  -1.265  1.00  0.00           C  
HETATM   13  C   UNL     1       8.266   1.513  -0.264  1.00  0.00           C  
HETATM   14  C   UNL     1       7.563   0.155  -0.214  1.00  0.00           C  
HETATM   15  N   UNL     1       3.815  -0.360   0.015  1.00  0.00           N  
HETATM   16  O   UNL     1       3.102  -0.937   2.038  1.00  0.00           O  
HETATM   17  C   UNL     1       1.434  -0.749   0.416  1.00  0.00           C  
HETATM   18  C   UNL     1       0.415  -1.091   1.310  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.181  -0.529  -1.353  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.192  -0.882  -0.470  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.935  -1.433   1.760  1.00  0.00           N  
HETATM   22  C   UNL     1      -2.869  -2.356   1.445  1.00  0.00           C  
HETATM   23  O   UNL     1      -3.813  -2.536   2.185  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.124  -2.304  -1.030  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.515  -0.979  -0.908  1.00  0.00           N  
HETATM   26  O   UNL     1      -4.298   0.031  -1.766  1.00  0.00           O  
HETATM   27  N   UNL     1      -2.728   1.346  -0.907  1.00  0.00           N  
HETATM   28  C   UNL     1      -1.938   2.443   1.124  1.00  0.00           C  
HETATM   29  N   UNL     1      -2.752   4.700   1.616  1.00  0.00           N  
HETATM   30  C   UNL     1      -3.684   3.511  -0.312  1.00  0.00           C  
HETATM   31  H   UNL     1       6.023  -0.648  -1.488  1.00  0.00           H  
HETATM   32  H   UNL     1       5.812   1.070  -1.073  1.00  0.00           H  
HETATM   33  H   UNL     1       5.505  -1.278   0.854  1.00  0.00           H  
HETATM   34  H   UNL     1       5.294   0.440   1.269  1.00  0.00           H  
HETATM   35  H   UNL     1       1.910  -0.191  -1.606  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.719  -3.510   0.069  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.415  -4.022   0.234  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.080  -3.963  -2.404  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.890  -2.368  -3.170  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.538  -3.085  -2.261  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.314   0.508   0.404  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.722   1.878  -0.568  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.652   4.193  -0.100  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.633   3.048  -2.138  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.244   2.299  -2.009  1.00  0.00           H  
HETATM   46  H   UNL     1       8.321   0.549  -2.298  1.00  0.00           H  
HETATM   47  H   UNL     1       9.607  -0.074  -1.132  1.00  0.00           H  
HETATM   48  H   UNL     1       8.981   1.740   0.527  1.00  0.00           H  
HETATM   49  H   UNL     1       7.695   2.362  -0.639  1.00  0.00           H  
HETATM   50  H   UNL     1       7.815  -0.512   0.610  1.00  0.00           H  
HETATM   51  H   UNL     1       3.601  -0.163  -0.910  1.00  0.00           H  
HETATM   52  H   UNL     1       0.650  -1.311   2.341  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.418  -0.304  -2.382  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.986  -0.967   2.609  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.208  -2.201  -1.076  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.726   2.002   1.734  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.059   2.628   1.742  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.941   4.884   2.187  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.140   5.557   1.252  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.456   3.059   0.312  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.049   4.455  -0.715  1.00  0.00           H  
CONECT    1   14    2   31   32                                       
CONECT    2   15    1   33   34                                       
CONECT    3   16   16   17   15                                       
CONECT    4   17   17   19   35                                       
CONECT    5   21   18   18   20                                       
CONECT    6   22   24   36   37                                       
CONECT    7   24   38   39   40                                       
CONECT    8   27   25   26   26                                       
CONECT    9   28   27   41   42                                       
CONECT   10   29   28   30   43                                       
CONECT   11   30   27   44   45                                       
CONECT   12   14   13   46   47                                       
CONECT   13   14   12   48   49                                       
CONECT   14    1   12   13   50                                       
CONECT   15    3    2   51                                            
CONECT   16    3    3                                                 
CONECT   17   18    3    4    4                                       
CONECT   18    5    5   17   52                                       
CONECT   19   20   20    4   53                                       
CONECT   20    5   25   19   19                                       
CONECT   21   22    5   54                                            
CONECT   22   23   23   21    6                                       
CONECT   23   22   22                                                 
CONECT   24    6   25    7   55                                       
CONECT   25   20    8   24                                            
CONECT   26    8    8                                                 
CONECT   27    9   11    8                                            
CONECT   28   10    9   56   57                                       
CONECT   29   10   58   59                                            
CONECT   30   10   11   60   61                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
CONECT   55   24                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
