HEADER    PROTEIN                                 07-JUN-21   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Scopolin                                          
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   07-JUN-21         0                                  
HETATM    1  C   UNK     0      32.779 -22.624   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      32.784 -25.704   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      34.114 -23.392   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      34.116 -24.932   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      35.447 -22.620   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      36.781 -23.388   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      36.783 -24.928   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      38.117 -25.698   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0      35.451 -25.700   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      31.447 -23.396   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      30.113 -22.626   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      30.113 -21.086   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      31.449 -24.936   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      30.115 -25.706   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0      28.781 -26.476   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      28.781 -28.016   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      30.115 -28.786   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      26.114 -28.016   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      27.448 -28.786   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      27.448 -30.326   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0      26.114 -26.476   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      24.780 -28.786   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0      27.448 -25.706   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0      24.780 -25.706   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0      23.447 -26.476   0.000  0.00  0.00           O+0
CONECT    1    3   10                                                       
CONECT    2    4   13                                                       
CONECT    3    1    5    4                                                  
CONECT    4    2    3    9                                                  
CONECT    5    3    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    9    8                                                  
CONECT    8    7                                                            
CONECT    9    4    7                                                       
CONECT   10    1   13   11                                                  
CONECT   11   10   12                                                       
CONECT   12   11                                                            
CONECT   13    2   10   14                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   23                                                  
CONECT   16   15   19   17                                                  
CONECT   17   16                                                            
CONECT   18   21   19   22                                                  
CONECT   19   18   16   20                                                  
CONECT   20   19                                                            
CONECT   21   23   18   24                                                  
CONECT   22   18                                                            
CONECT   23   15   21                                                       
CONECT   24   21   25                                                       
CONECT   25   24                                                            
MASTER        0    0    0    0    0    0    0    0   25    0   54    0
END