# generated using pymatgen data_Rb3CrS4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.46121149 _cell_length_b 9.46347524 _cell_length_c 10.83991595 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb3CrS4 _chemical_formula_sum 'Rb12 Cr4 S16' _cell_volume 970.56207034 _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 Rb Rb0 1 0.64795815 0.41609714 0.25000000 1.0 Rb Rb1 1 0.85204185 0.91609714 0.75000000 1.0 Rb Rb2 1 0.14795815 0.08390286 0.25000000 1.0 Rb Rb3 1 0.35204185 0.58390286 0.75000000 1.0 Rb Rb4 1 0.45275289 0.79354244 0.04216636 1.0 Rb Rb5 1 0.04724711 0.29354244 0.95783364 1.0 Rb Rb6 1 0.95275289 0.70645756 0.45783364 1.0 Rb Rb7 1 0.54724711 0.20645756 0.54216636 1.0 Rb Rb8 1 0.54724711 0.20645756 0.95783364 1.0 Rb Rb9 1 0.95275289 0.70645756 0.04216636 1.0 Rb Rb10 1 0.04724711 0.29354244 0.54216636 1.0 Rb Rb11 1 0.45275289 0.79354244 0.45783364 1.0 Cr Cr12 1 0.72219260 0.98359578 0.25000000 1.0 Cr Cr13 1 0.77780740 0.48359578 0.75000000 1.0 Cr Cr14 1 0.22219260 0.51640422 0.25000000 1.0 Cr Cr15 1 0.27780740 0.01640422 0.75000000 1.0 S S16 1 0.70470758 0.75969648 0.25000000 1.0 S S17 1 0.79529242 0.25969648 0.75000000 1.0 S S18 1 0.20470758 0.74030352 0.25000000 1.0 S S19 1 0.29529242 0.24030352 0.75000000 1.0 S S20 1 0.51527165 0.07425541 0.25000000 1.0 S S21 1 0.98472835 0.57425541 0.75000000 1.0 S S22 1 0.01527165 0.42574459 0.25000000 1.0 S S23 1 0.48472835 0.92574459 0.75000000 1.0 S S24 1 0.82917469 0.04535855 0.08680620 1.0 S S25 1 0.67082531 0.54535855 0.91319380 1.0 S S26 1 0.32917469 0.45464145 0.41319380 1.0 S S27 1 0.17082531 0.95464145 0.58680620 1.0 S S28 1 0.17082531 0.95464145 0.91319380 1.0 S S29 1 0.32917469 0.45464145 0.08680620 1.0 S S30 1 0.67082531 0.54535855 0.58680620 1.0 S S31 1 0.82917469 0.04535855 0.41319380 1.0