# generated using pymatgen data_ZrNb13P8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.73090087 _cell_length_b 7.73090056 _cell_length_c 13.99011367 _cell_angle_alpha 75.60855454 _cell_angle_beta 104.39144458 _cell_angle_gamma 153.99447840 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrNb13P8 _chemical_formula_sum 'Zr1 Nb13 P8' _cell_volume 354.48594811 _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 Zr Zr0 1 0.17654431 0.82345769 0.54088756 1.0 Nb Nb1 1 0.82821783 0.17178417 0.45807151 1.0 Nb Nb2 1 0.43197405 0.56802895 0.82893377 1.0 Nb Nb3 1 0.56826536 0.43173664 0.17264545 1.0 Nb Nb4 1 0.49964710 0.50035490 0.50011033 1.0 Nb Nb5 1 0.00001320 0.99998680 0.00025410 1.0 Nb Nb6 1 0.00236040 0.99764160 0.66657148 1.0 Nb Nb7 1 0.99456527 0.00543673 0.33203697 1.0 Nb Nb8 1 0.33736496 0.66263804 0.02728655 1.0 Nb Nb9 1 0.66252109 0.33748091 0.97302916 1.0 Nb Nb10 1 0.21026312 0.78973888 0.80230216 1.0 Nb Nb11 1 0.79025042 0.20975158 0.19969527 1.0 Nb Nb12 1 0.19585547 0.80414753 0.30990617 1.0 Nb Nb13 1 0.80693211 0.19306989 0.69109960 1.0 P P14 1 0.37297418 0.62702782 0.60116686 1.0 P P15 1 0.62290448 0.37709852 0.39321614 1.0 P P16 1 0.36964205 0.63035995 0.33480313 1.0 P P17 1 0.63006682 0.36993518 0.66729614 1.0 P P18 1 0.06429573 0.93570627 0.85036256 1.0 P P19 1 0.93536937 0.06463363 0.14915663 1.0 P P20 1 0.17357653 0.82642547 0.11224528 1.0 P P21 1 0.82642216 0.17357984 0.88892118 1.0