# data_comp_list loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level CXL CXL 'CYCLOHEXANOL ' non-polymer 19 7 M # data_comp_CXL # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.partial_charge CXL C1 C . 0.000 CXL C2 C . 0.000 CXL C3 C . 0.000 CXL C4 C . 0.000 CXL C5 C . 0.000 CXL C6 C . 0.000 CXL O O . 0.000 CXL H1 H . 0.000 CXL H21 H . 0.000 CXL H22 H . 0.000 CXL H31 H . 0.000 CXL H32 H . 0.000 CXL H41 H . 0.000 CXL H42 H . 0.000 CXL H51 H . 0.000 CXL H52 H . 0.000 CXL H61 H . 0.000 CXL H62 H . 0.000 CXL HO H . 0.000 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type CXL C1 C6 single CXL C1 C2 single CXL C1 O single CXL C1 H1 single CXL C2 C3 single CXL C2 H21 single CXL C2 H22 single CXL C3 C4 single CXL C3 H31 single CXL C3 H32 single CXL C4 C5 single CXL C4 H41 single CXL C4 H42 single CXL C5 C6 single CXL C5 H51 single CXL C5 H52 single CXL C6 H61 single CXL C6 H62 single CXL O HO single