# generated using pymatgen data_Nb3P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.13398559 _cell_length_b 10.17904894 _cell_length_c 10.17904894 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3P _chemical_formula_sum 'Nb24 P8' _cell_volume 531.94784003 _cell_formula_units_Z 8 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 0.72425239 0.16373394 0.65297785 1.0 Nb Nb1 1 0.22425239 0.34702215 0.66373394 1.0 Nb Nb2 1 0.22425239 0.15297785 0.83626606 1.0 Nb Nb3 1 0.72425239 0.33626606 0.84702215 1.0 Nb Nb4 1 0.27574761 0.83626606 0.34702215 1.0 Nb Nb5 1 0.77574761 0.65297785 0.33626606 1.0 Nb Nb6 1 0.77574761 0.84702215 0.16373394 1.0 Nb Nb7 1 0.27574761 0.66373394 0.15297785 1.0 Nb Nb8 1 0.51712893 0.10479566 0.26292205 1.0 Nb Nb9 1 0.01712893 0.73707795 0.60479566 1.0 Nb Nb10 1 0.01712893 0.76292205 0.89520434 1.0 Nb Nb11 1 0.51712893 0.39520434 0.23707795 1.0 Nb Nb12 1 0.48287107 0.89520434 0.73707795 1.0 Nb Nb13 1 0.98287107 0.26292205 0.39520434 1.0 Nb Nb14 1 0.98287107 0.23707795 0.10479566 1.0 Nb Nb15 1 0.48287107 0.60479566 0.76292205 1.0 Nb Nb16 1 0.23860077 0.05903070 0.53673517 1.0 Nb Nb17 1 0.73860077 0.46326483 0.55903070 1.0 Nb Nb18 1 0.73860077 0.03673517 0.94096930 1.0 Nb Nb19 1 0.23860077 0.44096930 0.96326483 1.0 Nb Nb20 1 0.76139923 0.94096930 0.46326483 1.0 Nb Nb21 1 0.26139923 0.53673517 0.44096930 1.0 Nb Nb22 1 0.26139923 0.96326483 0.05903070 1.0 Nb Nb23 1 0.76139923 0.55903070 0.03673517 1.0 P P24 1 0.02127923 0.04306801 0.27467541 1.0 P P25 1 0.52127923 0.72532459 0.54306801 1.0 P P26 1 0.52127923 0.77467541 0.95693199 1.0 P P27 1 0.02127923 0.45693199 0.22532459 1.0 P P28 1 0.97872077 0.95693199 0.72532459 1.0 P P29 1 0.47872077 0.27467541 0.45693199 1.0 P P30 1 0.47872077 0.22532459 0.04306801 1.0 P P31 1 0.97872077 0.54306801 0.77467541 1.0