# generated using pymatgen data_NaCoNi4P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59239047 _cell_length_b 10.20868485 _cell_length_c 11.74050642 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaCoNi4P3 _chemical_formula_sum 'Na4 Co4 Ni16 P12' _cell_volume 430.56642696 _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 Na Na0 1 0.25000000 0.58058480 0.70531796 1.0 Na Na1 1 0.25000000 0.91941520 0.20531796 1.0 Na Na2 1 0.75000000 0.41941520 0.29468204 1.0 Na Na3 1 0.75000000 0.08058480 0.79468204 1.0 Co Co4 1 0.25000000 0.46438708 0.93194740 1.0 Co Co5 1 0.25000000 0.03561292 0.43194740 1.0 Co Co6 1 0.75000000 0.53561292 0.06805260 1.0 Co Co7 1 0.75000000 0.96438708 0.56805260 1.0 Ni Ni8 1 0.25000000 0.71195480 0.99157574 1.0 Ni Ni9 1 0.25000000 0.78804520 0.49157574 1.0 Ni Ni10 1 0.75000000 0.28804520 0.00842426 1.0 Ni Ni11 1 0.75000000 0.21195480 0.50842426 1.0 Ni Ni12 1 0.25000000 0.40636224 0.48575977 1.0 Ni Ni13 1 0.25000000 0.09363776 0.98575977 1.0 Ni Ni14 1 0.75000000 0.59363776 0.51424023 1.0 Ni Ni15 1 0.75000000 0.90636224 0.01424023 1.0 Ni Ni16 1 0.25000000 0.22152845 0.17513584 1.0 Ni Ni17 1 0.25000000 0.27847155 0.67513584 1.0 Ni Ni18 1 0.75000000 0.77847155 0.82486416 1.0 Ni Ni19 1 0.75000000 0.72152845 0.32486416 1.0 Ni Ni20 1 0.25000000 0.88006112 0.70076341 1.0 Ni Ni21 1 0.25000000 0.61993888 0.20076341 1.0 Ni Ni22 1 0.75000000 0.11993888 0.29923659 1.0 Ni Ni23 1 0.75000000 0.38006112 0.79923659 1.0 P P24 1 0.25000000 0.42180130 0.11267393 1.0 P P25 1 0.25000000 0.07819870 0.61267393 1.0 P P26 1 0.75000000 0.57819870 0.88732607 1.0 P P27 1 0.75000000 0.92180130 0.38732607 1.0 P P28 1 0.25000000 0.26615990 0.86720839 1.0 P P29 1 0.25000000 0.23384010 0.36720839 1.0 P P30 1 0.75000000 0.73384010 0.13279161 1.0 P P31 1 0.75000000 0.76615990 0.63279161 1.0 P P32 1 0.25000000 0.60015679 0.39233154 1.0 P P33 1 0.25000000 0.89984321 0.89233154 1.0 P P34 1 0.75000000 0.39984321 0.60766846 1.0 P P35 1 0.75000000 0.10015679 0.10766846 1.0