# generated using pymatgen data_NaHf3(Co5P3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.56379747 _cell_length_b 10.04744846 _cell_length_c 11.53444802 _cell_angle_alpha 90.15654368 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaHf3(Co5P3)4 _chemical_formula_sum 'Na1 Hf3 Co20 P12' _cell_volume 413.01326182 _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 Na Na0 1 0.75000000 0.07932702 0.79679099 1.0 Hf Hf1 1 0.25000000 0.57922478 0.70134005 1.0 Hf Hf2 1 0.25000000 0.92050090 0.20269127 1.0 Hf Hf3 1 0.75000000 0.42077094 0.29728383 1.0 Co Co4 1 0.25000000 0.71489074 0.99186660 1.0 Co Co5 1 0.25000000 0.78542362 0.48891599 1.0 Co Co6 1 0.75000000 0.28652908 0.00872764 1.0 Co Co7 1 0.75000000 0.21544099 0.50739918 1.0 Co Co8 1 0.25000000 0.40980341 0.48351422 1.0 Co Co9 1 0.25000000 0.09101894 0.99078244 1.0 Co Co10 1 0.75000000 0.59264890 0.51522236 1.0 Co Co11 1 0.75000000 0.90448085 0.01782459 1.0 Co Co12 1 0.25000000 0.22581958 0.17889040 1.0 Co Co13 1 0.25000000 0.28100469 0.67368785 1.0 Co Co14 1 0.75000000 0.77524811 0.82541469 1.0 Co Co15 1 0.75000000 0.72409184 0.32342811 1.0 Co Co16 1 0.25000000 0.87682055 0.69877774 1.0 Co Co17 1 0.25000000 0.61728667 0.20092199 1.0 Co Co18 1 0.75000000 0.11709283 0.29868897 1.0 Co Co19 1 0.75000000 0.38375252 0.79942322 1.0 Co Co20 1 0.25000000 0.46493096 0.93155018 1.0 Co Co21 1 0.25000000 0.03539811 0.43135020 1.0 Co Co22 1 0.75000000 0.53474652 0.06856256 1.0 Co Co23 1 0.75000000 0.96433812 0.56667338 1.0 P P24 1 0.25000000 0.42081227 0.11550166 1.0 P P25 1 0.25000000 0.07838516 0.61719231 1.0 P P26 1 0.75000000 0.57824746 0.88359730 1.0 P P27 1 0.75000000 0.92156135 0.38407382 1.0 P P28 1 0.25000000 0.26275810 0.86547547 1.0 P P29 1 0.25000000 0.23554537 0.36797033 1.0 P P30 1 0.75000000 0.73451750 0.13362718 1.0 P P31 1 0.75000000 0.76587096 0.63434390 1.0 P P32 1 0.25000000 0.59998858 0.38996600 1.0 P P33 1 0.25000000 0.90186595 0.89012633 1.0 P P34 1 0.75000000 0.40000483 0.60983514 1.0 P P35 1 0.75000000 0.09984781 0.10856608 1.0