# generated using pymatgen data_Rb(ZrS2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.35247860 _cell_length_b 7.34525139 _cell_length_c 16.30324693 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb(ZrS2)2 _chemical_formula_sum 'Rb4 Zr8 S16' _cell_volume 760.71850606 _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 0.34953687 0.00000000 0.00000000 1.0 Rb Rb1 1 0.65046313 0.50000000 0.50000000 1.0 Rb Rb2 1 0.03062147 0.00000000 0.50000000 1.0 Rb Rb3 1 0.96937853 0.50000000 0.00000000 1.0 Zr Zr4 1 0.00042120 0.00000000 0.24825983 1.0 Zr Zr5 1 0.00042120 0.00000000 0.75174017 1.0 Zr Zr6 1 0.99957880 0.50000000 0.25174017 1.0 Zr Zr7 1 0.99957880 0.50000000 0.74825983 1.0 Zr Zr8 1 0.50000000 0.25000000 0.25000000 1.0 Zr Zr9 1 0.50000000 0.75000000 0.75000000 1.0 Zr Zr10 1 0.50000000 0.75000000 0.25000000 1.0 Zr Zr11 1 0.50000000 0.25000000 0.75000000 1.0 S S12 1 0.83448769 0.24820288 0.34232607 1.0 S S13 1 0.83448769 0.75179712 0.65767393 1.0 S S14 1 0.16551231 0.74820288 0.15767393 1.0 S S15 1 0.16551231 0.25179712 0.84232607 1.0 S S16 1 0.16551231 0.25179712 0.15767393 1.0 S S17 1 0.16551231 0.74820288 0.84232607 1.0 S S18 1 0.83448769 0.75179712 0.34232607 1.0 S S19 1 0.83448769 0.24820288 0.65767393 1.0 S S20 1 0.66712182 0.00000000 0.15840273 1.0 S S21 1 0.66712182 0.00000000 0.84159727 1.0 S S22 1 0.33287818 0.50000000 0.34159727 1.0 S S23 1 0.33287818 0.50000000 0.65840273 1.0 S S24 1 0.33570920 0.00000000 0.34016640 1.0 S S25 1 0.33570920 0.00000000 0.65983360 1.0 S S26 1 0.66429080 0.50000000 0.15983360 1.0 S S27 1 0.66429080 0.50000000 0.84016640 1.0