# generated using pymatgen data_Nb6AgSe8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.11537636 _cell_length_b 10.11537636 _cell_length_c 3.48452400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000235 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb6AgSe8 _chemical_formula_sum 'Nb6 Ag1 Se8' _cell_volume 308.77218684 _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 0.10831000 0.62099800 0.24996100 1.0 Nb Nb1 1 0.51268800 0.89169000 0.24996100 1.0 Nb Nb2 1 0.37900200 0.48731200 0.24996100 1.0 Nb Nb3 1 0.89169000 0.37900200 0.75003900 1.0 Nb Nb4 1 0.48731200 0.10831000 0.75003900 1.0 Nb Nb5 1 0.62099800 0.51268800 0.75003900 1.0 Ag Ag6 1 0.00000000 0.00000000 0.50000000 1.0 Se Se7 1 0.27791000 0.94055200 0.25027800 1.0 Se Se8 1 0.66264200 0.72209000 0.25027800 1.0 Se Se9 1 0.05944800 0.33735800 0.25027800 1.0 Se Se10 1 0.72209000 0.05944800 0.74972200 1.0 Se Se11 1 0.33735800 0.27791000 0.74972200 1.0 Se Se12 1 0.94055200 0.66264200 0.74972200 1.0 Se Se13 1 0.66666700 0.33333300 0.24972600 1.0 Se Se14 1 0.33333300 0.66666700 0.75027400 1.0