data_1010301 _chemical_name_systematic 'Lithium hydroxide' _chemical_formula_structural 'Li O H' _chemical_formula_sum 'H Li O' _publ_section_title ; Darstellung und Kristallstruktur von Lithiumhydroxyd. ; _publ_author_name 'Ernst, T' _journal_name_full ; Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie ; _journal_coden_ASTM ZPCBAL _journal_volume 20 _journal_year 1933 _journal_page_first 65 _journal_page_last 88 _cell_length_a 3.549(4) _cell_length_b 3.549(4) _cell_length_c 4.334(8) _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 54.6 _cell_formula_units_Z 2 _exptl_crystal_density_meas 1.46(0) _symmetry_space_group_name_H-M 'P 4/n m m S' _symmetry_Int_Tables_number 129 _symmetry_cell_setting tetragonal loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-x,-y,z' '1/2+x,1/2+y,-z' '1/2-x,1/2-y,-z' '-x,y,z' 'x,-y,z' '1/2-x,1/2+y,-z' '1/2+x,1/2-y,-z' '-y,x,-z' 'y,-x,-z' '1/2-y,1/2+x,z' '1/2+y,1/2-x,z' 'y,x,-z' '-y,-x,-z' '1/2+y,1/2+x,z' '1/2-y,1/2-x,z' loop_ _atom_type_symbol _atom_type_oxidation_number Li1+ 1.000 O2- -2.000 H1+ 1.000 loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_attached_hydrogens _atom_site_calc_flag Li1 Li1+ 2 a 0. 0. 0. 1. 0 d O1 O2- 2 c 0. 0.5 0.2 1. 1 d H1 H1+ 2 c -1. -1. -1. 1. 0 dum