# generated using pymatgen data_Rb2TaCuS2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.84256898 _cell_length_b 6.60229447 _cell_length_c 23.46160792 _cell_angle_alpha 86.84181357 _cell_angle_beta 82.84734285 _cell_angle_gamma 63.73872874 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb2TaCuS2 _chemical_formula_sum 'Rb8 Ta4 Cu4 S8' _cell_volume 805.28991852 _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 0.44420268 0.25092849 0.61819332 1.0 Rb Rb1 1 0.93760400 0.74907151 0.61819332 1.0 Rb Rb2 1 0.30486883 0.25092849 0.38180668 1.0 Rb Rb3 1 0.30579732 0.24907151 0.88180668 1.0 Rb Rb4 1 0.31332449 0.74907151 0.38180668 1.0 Rb Rb5 1 0.81239600 0.75092849 0.88180668 1.0 Rb Rb6 1 0.44513117 0.24907151 0.11819332 1.0 Rb Rb7 1 0.43667551 0.75092849 0.11819332 1.0 Ta Ta8 1 0.87500000 0.25000000 0.25000000 1.0 Ta Ta9 1 0.87500000 0.75000000 0.25000000 1.0 Ta Ta10 1 0.87500000 0.25000000 0.75000000 1.0 Ta Ta11 1 0.37500000 0.75000000 0.75000000 1.0 Cu Cu12 1 0.37500000 0.25000000 0.25000000 1.0 Cu Cu13 1 0.37500000 0.75000000 0.25000000 1.0 Cu Cu14 1 0.37500000 0.25000000 0.75000000 1.0 Cu Cu15 1 0.87500000 0.75000000 0.75000000 1.0 S S16 1 0.92807548 0.24944692 0.15087686 1.0 S S17 1 0.92104766 0.75055308 0.15087686 1.0 S S18 1 0.82247761 0.24944692 0.84912314 1.0 S S19 1 0.82192452 0.25055308 0.34912314 1.0 S S20 1 0.32839926 0.75055308 0.84912314 1.0 S S21 1 0.82895234 0.74944692 0.34912314 1.0 S S22 1 0.92752239 0.25055308 0.65087686 1.0 S S23 1 0.42160074 0.74944692 0.65087686 1.0