# generated using pymatgen data_CeCrS2O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.95918329 _cell_length_b 5.95918329 _cell_length_c 8.02688650 _cell_angle_alpha 89.79610506 _cell_angle_beta 89.79610506 _cell_angle_gamma 36.96267961 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeCrS2O _chemical_formula_sum 'Ce2 Cr2 S4 O2' _cell_volume 171.39767344 _cell_formula_units_Z 2 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 Ce Ce0 1 0.73468200 0.73468200 0.29338700 1.0 Ce Ce1 1 0.26531800 0.26531800 0.70661300 1.0 Cr Cr2 1 0.00000000 0.00000000 0.50000000 1.0 Cr Cr3 1 0.50000000 0.50000000 0.00000000 1.0 S S4 1 0.45120400 0.45120400 0.29771100 1.0 S S5 1 0.85875900 0.85875900 0.96522300 1.0 S S6 1 0.14124100 0.14124100 0.03477700 1.0 S S7 1 0.54879600 0.54879600 0.70228900 1.0 O O8 1 0.17361200 0.17361200 0.43318000 1.0 O O9 1 0.82638800 0.82638800 0.56682000 1.0