COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.576   4.114   2.001  1.00  0.00           C  
HETATM    2  N   UNL     1       1.403   3.172   1.235  1.00  0.00           N  
HETATM    3  C   UNL     1       0.567   2.231   0.478  1.00  0.00           C  
HETATM    4  C   UNL     1       0.019   2.933  -0.748  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.552   1.930  -1.746  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.382   0.905  -1.017  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.759   0.968  -1.064  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.522   0.013  -0.402  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.878   0.079  -0.452  1.00  0.00           O  
HETATM   10  C   UNL     1      -5.449   1.154  -1.200  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.904  -1.009   0.309  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.657  -1.944   0.951  1.00  0.00           O  
HETATM   13  C   UNL     1      -3.973  -3.133   0.225  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.518  -1.076   0.364  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.906  -2.072   1.057  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.717  -1.865   2.459  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.757  -0.110  -0.301  1.00  0.00           C  
HETATM   18  C   UNL     1       0.734  -0.163  -0.226  1.00  0.00           C  
HETATM   19  C   UNL     1       1.322  -1.373  -0.487  1.00  0.00           C  
HETATM   20  C   UNL     1       2.606  -1.772  -0.546  1.00  0.00           C  
HETATM   21  C   UNL     1       3.736  -1.031  -0.384  1.00  0.00           C  
HETATM   22  O   UNL     1       4.923  -1.675  -0.502  1.00  0.00           O  
HETATM   23  C   UNL     1       4.876  -3.074  -0.787  1.00  0.00           C  
HETATM   24  C   UNL     1       3.774   0.331  -0.107  1.00  0.00           C  
HETATM   25  O   UNL     1       4.889   0.835  -0.073  1.00  0.00           O  
HETATM   26  C   UNL     1       2.731   1.180   0.131  1.00  0.00           C  
HETATM   27  C   UNL     1       1.397   1.019   0.109  1.00  0.00           C  
HETATM   28  H   UNL     1       1.221   4.799   2.551  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.057   4.681   1.318  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.049   3.561   2.702  1.00  0.00           H  
HETATM   31  H   UNL     1       2.045   2.681   1.838  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.266   1.914   1.106  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.768   3.623  -0.444  1.00  0.00           H  
HETATM   34  H   UNL     1       0.821   3.495  -1.227  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.176   2.454  -2.470  1.00  0.00           H  
HETATM   36  H   UNL     1       0.266   1.430  -2.266  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.245   1.760  -1.615  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.536   1.089  -1.158  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.125   2.104  -0.775  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.121   1.089  -2.237  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.645  -3.753   0.818  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.458  -2.867  -0.714  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.057  -3.686   0.018  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.176  -0.933   2.619  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.687  -1.812   2.952  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.144  -2.694   2.874  1.00  0.00           H  
HETATM   47  H   UNL     1       0.614  -2.165  -0.685  1.00  0.00           H  
HETATM   48  H   UNL     1       2.761  -2.821  -0.748  1.00  0.00           H  
HETATM   49  H   UNL     1       5.892  -3.465  -0.855  1.00  0.00           H  
HETATM   50  H   UNL     1       4.342  -3.590   0.011  1.00  0.00           H  
HETATM   51  H   UNL     1       4.360  -3.236  -1.733  1.00  0.00           H  
HETATM   52  H   UNL     1       3.040   2.182   0.390  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    3    1   31                                            
CONECT    3    4   27    2   32                                       
CONECT    4    5    3   33   34                                       
CONECT    5    6    4   35   36                                       
CONECT    6    7    7   17    5                                       
CONECT    7    8    6    6   37                                       
CONECT    8    9   11   11    7                                       
CONECT    9   10    8                                                 
CONECT   10    9   38   39   40                                       
CONECT   11   12    8    8   14                                       
CONECT   12   13   11                                                 
CONECT   13   12   41   42   43                                       
CONECT   14   11   15   17   17                                       
CONECT   15   14   16                                                 
CONECT   16   15   44   45   46                                       
CONECT   17   14   14    6   18                                       
CONECT   18   17   19   19   27                                       
CONECT   19   18   18   20   47                                       
CONECT   20   19   21   21   48                                       
CONECT   21   20   20   24   22                                       
CONECT   22   21   23                                                 
CONECT   23   22   49   50   51                                       
CONECT   24   21   26   25   25                                       
CONECT   25   24   24                                                 
CONECT   26   27   27   24   52                                       
CONECT   27   18    3   26   26                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   26                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
