data_comp_carborone_7032961_1
_chem_comp.pdbx_type        HETAIN
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.orig_atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.model_Cartn_x
_chem_comp_atom.model_Cartn_y
_chem_comp_atom.model_Cartn_z
LIG   B1   B1   B     -0.109219   0.631554   1.89804   
LIG   B2   B2   B     -0.250664   2.39991   1.99024   
LIG   B5   B5   B     -0.306408   2.37013   4.88942   
LIG   B6   B6   B     0.663917   2.87808   3.4734   
LIG   B7   B7   B     1.28538   1.57889   2.43419   
LIG   B9   B9   B     1.26933   1.3804   4.19995   
LIG   B3   B3   B     -1.12027   3.0089   3.42329   
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
LIG   B1   B2   SINGLE      
LIG   B1   B7   SINGLE      
LIG   B2   B6   SINGLE      
LIG   B2   B7   SINGLE      
LIG   B2   B3   SINGLE      
LIG   B5   B6   SINGLE      
LIG   B5   B9   SINGLE      
LIG   B5   B3   SINGLE      
LIG   B6   B7   SINGLE      
LIG   B6   B9   SINGLE      
LIG   B6   B3   SINGLE      
LIG   B7   B9   SINGLE      
