# generated using pymatgen data_Hf3P2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57703592 _cell_length_b 9.80707377 _cell_length_c 10.15547581 _cell_angle_alpha 89.99654962 _cell_angle_beta 89.99999807 _cell_angle_gamma 90.00000267 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3P2 _chemical_formula_sum 'Hf12 P8' _cell_volume 356.25668221 _cell_formula_units_Z 4 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 Hf Hf0 1 0.24999985 0.79821083 0.21603487 1.0 Hf Hf1 1 0.74999987 0.20177380 0.78397054 1.0 Hf Hf2 1 0.74999985 0.29819595 0.28390033 1.0 Hf Hf3 1 0.24999989 0.70182354 0.71610693 1.0 Hf Hf4 1 0.24999977 0.43423361 0.87456020 1.0 Hf Hf5 1 0.74999981 0.56580260 0.12544950 1.0 Hf Hf6 1 0.74999971 0.93421063 0.62549468 1.0 Hf Hf7 1 0.24999980 0.06575727 0.37450453 1.0 Hf Hf8 1 0.24999963 0.37321020 0.54543365 1.0 Hf Hf9 1 0.74999962 0.62682705 0.45455622 1.0 Hf Hf10 1 0.74999973 0.87319879 0.95459115 1.0 Hf Hf11 1 0.24999967 0.12676583 0.04542268 1.0 P P12 1 0.24999966 0.67783160 0.97255830 1.0 P P13 1 0.74999968 0.32219236 0.02744381 1.0 P P14 1 0.74999962 0.17779917 0.52745194 1.0 P P15 1 0.24999958 0.82218696 0.47253473 1.0 P P16 1 0.24999982 0.99869755 0.80714034 1.0 P P17 1 0.74999986 0.00125765 0.19285755 1.0 P P18 1 0.74999979 0.49873868 0.69288689 1.0 P P19 1 0.24999979 0.50128793 0.30710216 1.0