# generated using pymatgen data_La3CoCl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.17839824 _cell_length_b 10.17839842 _cell_length_c 10.17839807 _cell_angle_alpha 109.47122189 _cell_angle_beta 109.47122225 _cell_angle_gamma 109.47121866 _symmetry_Int_Tables_number 1 _chemical_formula_structural La3CoCl3 _chemical_formula_sum 'La12 Co4 Cl12' _cell_volume 811.73901824 _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 0.47205832 0.48602916 0.23602916 1.0 La La1 1 0.75000000 0.23602916 0.26397084 1.0 La La2 1 0.75000000 0.01397084 0.48602916 1.0 La La3 1 0.23602916 0.47205832 0.48602916 1.0 La La4 1 0.26397084 0.75000000 0.23602916 1.0 La La5 1 0.02794168 0.26397084 0.01397084 1.0 La La6 1 0.01397084 0.02794168 0.26397084 1.0 La La7 1 0.48602916 0.75000000 0.01397084 1.0 La La8 1 0.48602916 0.23602916 0.47205832 1.0 La La9 1 0.01397084 0.48602916 0.75000000 1.0 La La10 1 0.26397084 0.01397084 0.02794168 1.0 La La11 1 0.23602916 0.26397084 0.75000000 1.0 Co Co12 1 0.25000000 0.25000000 0.25000000 1.0 Co Co13 1 0.50000000 0.00000000 0.25000000 1.0 Co Co14 1 0.00000000 0.25000000 0.50000000 1.0 Co Co15 1 0.25000000 0.50000000 0.00000000 1.0 Cl Cl16 1 0.25000000 0.75408417 0.74591583 1.0 Cl Cl17 1 0.50816734 0.50408417 0.75408417 1.0 Cl Cl18 1 0.99183266 0.74591583 0.99591583 1.0 Cl Cl19 1 0.74591583 0.25000000 0.75408417 1.0 Cl Cl20 1 0.99591583 0.99183266 0.74591583 1.0 Cl Cl21 1 0.25000000 0.99591583 0.50408417 1.0 Cl Cl22 1 0.75408417 0.50816734 0.50408417 1.0 Cl Cl23 1 0.50408417 0.25000000 0.99591583 1.0 Cl Cl24 1 0.75408417 0.74591583 0.25000000 1.0 Cl Cl25 1 0.74591583 0.99591583 0.99183266 1.0 Cl Cl26 1 0.99591583 0.50408417 0.25000000 1.0 Cl Cl27 1 0.50408417 0.75408417 0.50816734 1.0