# generated using pymatgen data_NiAsPd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.18456989 _cell_length_b 6.18456989 _cell_length_c 3.74621578 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999821 _symmetry_Int_Tables_number 1 _chemical_formula_structural NiAsPd _chemical_formula_sum 'Ni3 As3 Pd3' _cell_volume 124.09161370 _cell_formula_units_Z 3 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 Ni Ni0 1 -0.00000000 0.75068054 -0.00000000 1.0 Ni Ni1 1 0.24931946 0.24931946 -0.00000000 1.0 Ni Ni2 1 0.75068054 -0.00000000 0.00000000 1.0 As As3 1 0.33333300 0.66666700 -0.00000000 1.0 As As4 1 0.66666700 0.33333300 -0.00000000 1.0 As As5 1 -0.00000000 0.00000000 0.50000000 1.0 Pd Pd6 1 0.00000000 0.41050803 0.50000000 1.0 Pd Pd7 1 0.58949197 0.58949197 0.50000000 1.0 Pd Pd8 1 0.41050803 0.00000000 0.50000000 1.0