COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.485  -2.045  -2.752  1.00  0.00           C  
HETATM    2  O   UNL     1       4.747  -1.767  -1.375  1.00  0.00           O  
HETATM    3  C   UNL     1       3.854  -0.976  -0.723  1.00  0.00           C  
HETATM    4  C   UNL     1       4.047  -0.665   0.620  1.00  0.00           C  
HETATM    5  C   UNL     1       3.134   0.142   1.279  1.00  0.00           C  
HETATM    6  O   UNL     1       5.129  -1.152   1.283  1.00  0.00           O  
HETATM    7  C   UNL     1       2.753  -0.473  -1.396  1.00  0.00           C  
HETATM    8  C   UNL     1       1.848   0.337  -0.734  1.00  0.00           C  
HETATM    9  C   UNL     1       2.034   0.637   0.602  1.00  0.00           C  
HETATM   10  C   UNL     1       1.045   1.520   1.319  1.00  0.00           C  
HETATM   11  C   UNL     1       1.221   3.017   1.019  1.00  0.00           C  
HETATM   12  C   UNL     1       2.366   3.319   0.051  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.138   2.951   0.352  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.842   3.760  -0.213  1.00  0.00           O  
HETATM   15  N   UNL     1      -0.258   1.625   0.638  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.266   0.689   0.374  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.413   1.078  -0.306  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.116  -0.627   0.787  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.111  -1.555   0.520  1.00  0.00           C  
HETATM   20  O   UNL     1      -1.961  -2.846   0.920  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.756  -3.175   1.614  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.259  -1.167  -0.160  1.00  0.00           C  
HETATM   23  O   UNL     1      -4.236  -2.078  -0.422  1.00  0.00           O  
HETATM   24  C   UNL     1      -5.263  -2.229   0.561  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.411   0.153  -0.568  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.534   0.534  -1.233  1.00  0.00           O  
HETATM   27  C   UNL     1      -4.623   1.906  -1.622  1.00  0.00           C  
HETATM   28  H   UNL     1       3.524  -2.551  -2.844  1.00  0.00           H  
HETATM   29  H   UNL     1       4.459  -1.110  -3.312  1.00  0.00           H  
HETATM   30  H   UNL     1       5.273  -2.685  -3.150  1.00  0.00           H  
HETATM   31  H   UNL     1       3.281   0.385   2.321  1.00  0.00           H  
HETATM   32  H   UNL     1       5.907  -0.579   1.243  1.00  0.00           H  
HETATM   33  H   UNL     1       2.601  -0.712  -2.438  1.00  0.00           H  
HETATM   34  H   UNL     1       0.988   0.725  -1.259  1.00  0.00           H  
HETATM   35  H   UNL     1       0.966   1.292   2.382  1.00  0.00           H  
HETATM   36  H   UNL     1       1.243   3.643   1.911  1.00  0.00           H  
HETATM   37  H   UNL     1       2.182   2.817  -0.899  1.00  0.00           H  
HETATM   38  H   UNL     1       2.429   4.395  -0.113  1.00  0.00           H  
HETATM   39  H   UNL     1       3.304   2.961   0.475  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.527   2.102  -0.630  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.224  -0.929   1.315  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.764  -4.233   1.876  1.00  0.00           H  
HETATM   43  H   UNL     1       0.101  -2.966   0.974  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.685  -2.577   2.523  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.976  -2.983   0.229  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.818  -2.540   1.506  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.777  -1.278   0.698  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.793   2.151  -2.285  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.566   2.076  -2.142  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.579   2.539  -0.735  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    3    1                                                 
CONECT    3    7    7    4    2                                       
CONECT    4    5    5    3    6                                       
CONECT    5    9    4    4   31                                       
CONECT    6    4   32                                                 
CONECT    7    8    3    3   33                                       
CONECT    8    9    9    7   34                                       
CONECT    9   10    8    8    5                                       
CONECT   10   15   11    9   35                                       
CONECT   11   13   12   10   36                                       
CONECT   12   11   37   38   39                                       
CONECT   13   14   14   15   11                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   10                                            
CONECT   16   18   18   17   15                                       
CONECT   17   25   25   16   40                                       
CONECT   18   19   16   16   41                                       
CONECT   19   20   22   22   18                                       
CONECT   20   21   19                                                 
CONECT   21   20   42   43   44                                       
CONECT   22   19   19   23   25                                       
CONECT   23   24   22                                                 
CONECT   24   23   45   46   47                                       
CONECT   25   22   26   17   17                                       
CONECT   26   25   27                                                 
CONECT   27   26   48   49   50                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
