# generated using pymatgen data_La2CoO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.51368069 _cell_length_b 13.33616522 _cell_length_c 5.51412223 _cell_angle_alpha 78.03675300 _cell_angle_beta 89.99122202 _cell_angle_gamma 78.01365810 _symmetry_Int_Tables_number 1 _chemical_formula_structural La2CoO4 _chemical_formula_sum 'La8 Co4 O16' _cell_volume 387.61638067 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy La La0 1 0.93142800 0.13777900 0.43116400 1.0 La La1 1 0.18150900 0.63779700 0.18117700 1.0 La La2 1 0.68110900 0.63778600 0.68121300 1.0 La La3 1 0.43144700 0.13778000 0.93151100 1.0 La La4 1 0.31857700 0.36221200 0.31885700 1.0 La La5 1 0.56860300 0.86222500 0.06852300 1.0 La La6 1 0.06851100 0.86222200 0.56881000 1.0 La La7 1 0.81883400 0.36220400 0.81874000 1.0 Co Co8 1 0.50000500 0.00000000 0.49999800 1.0 Co Co9 1 0.74999900 0.50000100 0.25000300 1.0 Co Co10 1 0.24999300 0.50000000 0.75001700 1.0 Co Co11 1 0.00000300 0.00000000 0.99998400 1.0 O O12 1 0.25001700 0.99997500 0.75001600 1.0 O O13 1 0.50000700 0.49999800 0.49999900 1.0 O O14 1 0.99999300 0.49999700 0.00000100 1.0 O O15 1 0.74998700 0.00001900 0.24998900 1.0 O O16 1 0.25001200 0.00001800 0.24993400 1.0 O O17 1 0.49995900 0.50000400 0.00001800 1.0 O O18 1 0.99999000 0.49999600 0.50005900 1.0 O O19 1 0.75003600 0.99998800 0.74999800 1.0 O O20 1 0.84091900 0.31819700 0.34088300 1.0 O O21 1 0.09082900 0.81818400 0.09082300 1.0 O O22 1 0.59085700 0.81819800 0.59084600 1.0 O O23 1 0.34087800 0.31818100 0.84086400 1.0 O O24 1 0.40915400 0.18179800 0.40915200 1.0 O O25 1 0.65905800 0.68180600 0.15911300 1.0 O O26 1 0.15914600 0.68181700 0.65911700 1.0 O O27 1 0.90914000 0.18181900 0.90918900 1.0