# generated using pymatgen data_Li2Hf(NiAs)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.17850691 _cell_length_b 6.17850633 _cell_length_c 3.84372271 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.70700278 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Hf(NiAs)3 _chemical_formula_sum 'Li2 Hf1 Ni3 As3' _cell_volume 126.15701489 _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 Li Li0 1 0.57170924 0.00322218 0.00000000 1.0 Li Li1 1 0.00322218 0.57170924 0.00000000 1.0 Hf Hf2 1 0.42711001 0.42711001 0.00000000 1.0 Ni Ni3 1 0.24120459 0.00883809 0.50000000 1.0 Ni Ni4 1 0.00883809 0.24120459 0.50000000 1.0 Ni Ni5 1 0.75868552 0.75868552 0.50000000 1.0 As As6 1 0.32931119 0.67451744 0.50000000 1.0 As As7 1 0.67451744 0.32931119 0.50000000 1.0 As As8 1 0.98540272 0.98540272 0.00000000 1.0