data_comp_carborone_4337129_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     -0.0449063   11.2419   5.39593   
LIG   B2   B2   B     0.335267   11.3756   3.70007   
LIG   B3   B3   B     -0.700271   12.5309   4.49982   
LIG   B4   B4   B     2.0193   12.0425   3.44541   
LIG   B5   B5   B     2.1738   13.6664   4.07586   
LIG   B6   B6   B     2.82102   12.3674   4.96371   
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   B3   SINGLE      
LIG   B2   B3   SINGLE      
LIG   B2   B4   SINGLE      
LIG   B4   B5   SINGLE      
LIG   B4   B6   SINGLE      
LIG   B5   B6   SINGLE      
