# generated using pymatgen data_KCrS2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.39042940 _cell_length_b 7.39042904 _cell_length_c 7.39042695 _cell_angle_alpha 28.59531731 _cell_angle_beta 28.59532131 _cell_angle_gamma 28.59532799 _symmetry_Int_Tables_number 1 _chemical_formula_structural KCrS2 _chemical_formula_sum 'K1 Cr1 S2' _cell_volume 81.73973948 _cell_formula_units_Z 1 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 K K0 1 0.50000000 0.50000000 0.50000000 1.0 Cr Cr1 1 0.00000000 -0.00000000 -0.00000000 1.0 S S2 1 0.72606458 0.72606458 0.72606458 1.0 S S3 1 0.27393542 0.27393542 0.27393542 1.0