COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.762   3.143   1.077  1.00  0.00           C  
HETATM    2  C   UNL     1       5.536  -0.126  -1.269  1.00  0.00           C  
HETATM    3  C   UNL     1       3.980  -1.239   0.684  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.494  -1.675  -0.062  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.563   0.578   0.445  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.353  -0.740   0.034  1.00  0.00           C  
HETATM    7  C   UNL     1       0.934  -1.174  -0.286  1.00  0.00           C  
HETATM    8  C   UNL     1       2.000  -0.296  -0.195  1.00  0.00           C  
HETATM    9  C   UNL     1       1.781   1.021   0.214  1.00  0.00           C  
HETATM   10  C   UNL     1       0.502   1.451   0.533  1.00  0.00           C  
HETATM   11  N   UNL     1       3.292  -0.728  -0.509  1.00  0.00           N  
HETATM   12  C   UNL     1       4.078   0.324  -1.159  1.00  0.00           C  
HETATM   13  C   UNL     1       4.007   1.595  -0.352  1.00  0.00           C  
HETATM   14  N   UNL     1       2.865   1.906   0.299  1.00  0.00           N  
HETATM   15  O   UNL     1       4.968   2.332  -0.288  1.00  0.00           O  
HETATM   16  N   UNL     1      -1.428  -2.987  -0.108  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.613  -3.480  -0.189  1.00  0.00           N  
HETATM   18  C   UNL     1      -3.499  -2.520  -0.199  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.822  -1.339  -0.113  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.371  -0.049  -0.090  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.115   0.371   1.004  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.654   1.642   1.024  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.453   2.497  -0.045  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.713   2.081  -1.137  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.167   0.812  -1.160  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.043   3.883  -0.021  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.994  -2.688  -0.285  1.00  0.00           C  
HETATM   28  C   UNL     1       3.301  -2.367   1.463  1.00  0.00           C  
HETATM   29  C   UNL     1       4.545  -2.659   0.621  1.00  0.00           C  
HETATM   30  H   UNL     1       3.076   2.954   2.104  1.00  0.00           H  
HETATM   31  H   UNL     1       3.404   3.905   0.635  1.00  0.00           H  
HETATM   32  H   UNL     1       1.729   3.490   1.072  1.00  0.00           H  
HETATM   33  H   UNL     1       5.591  -1.040  -1.861  1.00  0.00           H  
HETATM   34  H   UNL     1       6.123   0.655  -1.753  1.00  0.00           H  
HETATM   35  H   UNL     1       5.935  -0.315  -0.272  1.00  0.00           H  
HETATM   36  H   UNL     1       4.541  -0.499   1.256  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.559   0.915   0.689  1.00  0.00           H  
HETATM   38  H   UNL     1       1.098  -2.193  -0.604  1.00  0.00           H  
HETATM   39  H   UNL     1       0.338   2.471   0.847  1.00  0.00           H  
HETATM   40  H   UNL     1       3.682   0.507  -2.158  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.273  -0.296   1.839  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.233   1.970   1.875  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.559   2.750  -1.970  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.588   0.488  -2.012  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.330   4.573   0.430  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.263   4.202  -1.039  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.962   3.877   0.565  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.409  -2.767   0.719  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.428  -1.825  -0.791  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.226  -3.593  -0.847  1.00  0.00           H  
HETATM   51  H   UNL     1       3.415  -2.370   2.547  1.00  0.00           H  
HETATM   52  H   UNL     1       2.343  -2.731   1.090  1.00  0.00           H  
HETATM   53  H   UNL     1       4.406  -3.215  -0.307  1.00  0.00           H  
HETATM   54  H   UNL     1       5.477  -2.854   1.150  1.00  0.00           H  
CONECT    1   14   30   31   32                                       
CONECT    2   12   33   34   35                                       
CONECT    3   28   29   11   36                                       
CONECT    4   19    6   16   16                                       
CONECT    5    6    6   10   37                                       
CONECT    6    7    4    5    5                                       
CONECT    7    8    8    6   38                                       
CONECT    8   11    7    7    9                                       
CONECT    9    8   14   10   10                                       
CONECT   10    9    9    5   39                                       
CONECT   11    3    8   12                                            
CONECT   12   11   13    2   40                                       
CONECT   13   12   15   15   14                                       
CONECT   14   13    9    1                                            
CONECT   15   13   13                                                 
CONECT   16    4    4   17                                            
CONECT   17   18   18   16                                            
CONECT   18   27   19   17   17                                       
CONECT   19   20   18    4                                            
CONECT   20   21   21   25   19                                       
CONECT   21   22   20   20   41                                       
CONECT   22   23   23   21   42                                       
CONECT   23   26   22   22   24                                       
CONECT   24   23   25   25   43                                       
CONECT   25   24   24   20   44                                       
CONECT   26   23   45   46   47                                       
CONECT   27   18   48   49   50                                       
CONECT   28   29    3   51   52                                       
CONECT   29   28    3   53   54                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
