# generated using pymatgen data_Nb4RhS8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.71118876 _cell_length_b 6.71118893 _cell_length_c 12.01182061 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000410 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4RhS8 _chemical_formula_sum 'Nb8 Rh2 S16' _cell_volume 468.53104306 _cell_formula_units_Z 2 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 0.25000000 1.0 Nb Nb1 1 0.00000000 0.00000000 0.75000000 1.0 Nb Nb2 1 0.50808247 0.01616494 0.25000000 1.0 Nb Nb3 1 0.98383506 0.49191753 0.25000000 1.0 Nb Nb4 1 0.50808247 0.49191753 0.25000000 1.0 Nb Nb5 1 0.49191753 0.98383506 0.75000000 1.0 Nb Nb6 1 0.01616494 0.50808247 0.75000000 1.0 Nb Nb7 1 0.49191753 0.50808247 0.75000000 1.0 Rh Rh8 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 0.88501245 1.0 S S11 1 0.66666700 0.33333300 0.11498755 1.0 S S12 1 0.66666700 0.33333300 0.38501245 1.0 S S13 1 0.33333300 0.66666700 0.61498755 1.0 S S14 1 0.83373024 0.66746049 0.87908357 1.0 S S15 1 0.33253951 0.16626976 0.87908357 1.0 S S16 1 0.83373024 0.16626976 0.87908357 1.0 S S17 1 0.16626976 0.33253951 0.12091643 1.0 S S18 1 0.66746049 0.83373024 0.12091643 1.0 S S19 1 0.16626976 0.83373024 0.12091643 1.0 S S20 1 0.16626976 0.33253951 0.37908357 1.0 S S21 1 0.66746049 0.83373024 0.37908357 1.0 S S22 1 0.16626976 0.83373024 0.37908357 1.0 S S23 1 0.83373024 0.66746049 0.62091643 1.0 S S24 1 0.33253951 0.16626976 0.62091643 1.0 S S25 1 0.83373024 0.16626976 0.62091643 1.0