# generated using pymatgen data_Nb8CdRhS16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73602290 _cell_length_b 6.73602295 _cell_length_c 12.72175116 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999481 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb8CdRhS16 _chemical_formula_sum 'Nb8 Cd1 Rh1 S16' _cell_volume 499.90175765 _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 Nb Nb0 1 0.00000000 0.00000000 0.23476509 1.0 Nb Nb1 1 0.00000000 0.00000000 0.76523491 1.0 Nb Nb2 1 0.50607162 0.01214424 0.23228321 1.0 Nb Nb3 1 0.98785576 0.49392838 0.23228321 1.0 Nb Nb4 1 0.50607162 0.49392838 0.23228321 1.0 Nb Nb5 1 0.49392838 0.98785576 0.76771679 1.0 Nb Nb6 1 0.01214424 0.50607162 0.76771679 1.0 Nb Nb7 1 0.49392838 0.50607162 0.76771679 1.0 Cd Cd8 1 0.00000000 0.00000000 0.50000000 1.0 Rh Rh9 1 0.00000000 0.00000000 0.00000000 1.0 S S10 1 0.33333300 0.66666700 0.89302829 1.0 S S11 1 0.66666700 0.33333300 0.10697171 1.0 S S12 1 0.66666700 0.33333300 0.35920428 1.0 S S13 1 0.33333300 0.66666700 0.64079572 1.0 S S14 1 0.16892575 0.83107425 0.35579615 1.0 S S15 1 0.16892575 0.33785250 0.35579615 1.0 S S16 1 0.66214750 0.83107425 0.35579615 1.0 S S17 1 0.83107425 0.16892575 0.64420385 1.0 S S18 1 0.83107425 0.66214750 0.64420385 1.0 S S19 1 0.33785250 0.16892575 0.64420385 1.0 S S20 1 0.83370800 0.16629200 0.88709642 1.0 S S21 1 0.83370800 0.66741599 0.88709642 1.0 S S22 1 0.33258401 0.16629200 0.88709642 1.0 S S23 1 0.16629200 0.83370800 0.11290358 1.0 S S24 1 0.16629200 0.33258401 0.11290358 1.0 S S25 1 0.66741599 0.83370800 0.11290358 1.0