HEADER    PROTEIN                                 02-APR-20   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Echinenone                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   02-APR-20         0                                  
HETATM    1  C   UNK     0     -12.263  -0.388   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0     -10.929   0.382   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0     -14.930  -0.388   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -9.595  -0.388   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0     -14.930  -1.928   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -8.262   0.382   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -6.928  -0.388   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -8.262   1.922   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -5.594   0.382   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -4.261  -0.388   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -2.927   0.382   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -1.593  -0.388   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.927   1.922   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -0.260   0.382   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       1.074  -0.388   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       2.408   0.382   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       3.741  -0.388   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       5.075   0.382   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       3.741  -1.928   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       6.409  -0.388   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       7.742   0.382   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       9.076  -0.388   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      10.410   0.382   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       9.076  -1.928   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      11.743  -0.388   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      13.077   0.382   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      14.411   2.692   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      15.744   0.382   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      15.744   1.922   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      13.077   1.922   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      11.743   2.692   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      13.641  -1.721   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      14.411  -0.388   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      15.181  -1.721   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0     -14.366   1.716   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0     -13.596   0.382   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0     -12.826   1.716   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0     -13.596  -2.698   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0     -13.596  -4.238   0.000  0.00  0.00           O+0
HETATM   40  C   UNK     0     -12.263  -1.928   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0     -10.929  -2.698   0.000  0.00  0.00           C+0
CONECT    1   40   36    2                                                  
CONECT    2    1    4                                                       
CONECT    3   36    5                                                       
CONECT    4    2    6                                                       
CONECT    5   38    3                                                       
CONECT    6    4    7    8                                                  
CONECT    7    6    9                                                       
CONECT    8    6                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12   13                                                  
CONECT   12   11   14                                                       
CONECT   13   11                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18   19                                                  
CONECT   18   17   20                                                       
CONECT   19   17                                                            
CONECT   20   18   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23   24                                                  
CONECT   23   22   25                                                       
CONECT   24   22                                                            
CONECT   25   23   26                                                       
CONECT   26   25   30   33                                                  
CONECT   27   30   29                                                       
CONECT   28   33   29                                                       
CONECT   29   27   28                                                       
CONECT   30   26   27   31                                                  
CONECT   31   30                                                            
CONECT   32   33                                                            
CONECT   33   26   28   32   34                                             
CONECT   34   33                                                            
CONECT   35   36                                                            
CONECT   36    1    3   35   37                                             
CONECT   37   36                                                            
CONECT   38   40    5   39                                                  
CONECT   39   38                                                            
CONECT   40    1   38   41                                                  
CONECT   41   40                                                            
MASTER        0    0    0    0    0    0    0    0   41    0   84    0
END