# generated using pymatgen data_NdPa(WN3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.49471139 _cell_length_b 5.64038917 _cell_length_c 7.91624351 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdPa(WN3)2 _chemical_formula_sum 'Nd2 Pa2 W4 N12' _cell_volume 245.34267808 _cell_formula_units_Z 2 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 Nd Nd0 1 0.50648500 0.54198871 0.75000000 1.0 Nd Nd1 1 0.99351500 0.04198871 0.75000000 1.0 Pa Pa2 1 0.49408860 0.43682389 0.25000000 1.0 Pa Pa3 1 0.00591140 0.93682389 0.25000000 1.0 W W4 1 0.50584866 0.00012214 0.50377766 1.0 W W5 1 0.99415134 0.50012214 0.99622234 1.0 W W6 1 0.99415134 0.50012214 0.50377766 1.0 W W7 1 0.50584866 0.00012214 0.99622234 1.0 N N8 1 0.70255236 0.29452181 0.53257250 1.0 N N9 1 0.30031954 0.69954580 0.05822512 1.0 N N10 1 0.19968046 0.19954580 0.05822512 1.0 N N11 1 0.43506520 0.99227403 0.75000000 1.0 N N12 1 0.89078093 0.54053488 0.25000000 1.0 N N13 1 0.30031954 0.69954580 0.44177488 1.0 N N14 1 0.79744764 0.79452181 0.96742750 1.0 N N15 1 0.70255236 0.29452181 0.96742750 1.0 N N16 1 0.79744764 0.79452181 0.53257250 1.0 N N17 1 0.06493480 0.49227403 0.75000000 1.0 N N18 1 0.19968046 0.19954580 0.44177488 1.0 N N19 1 0.60921907 0.04053488 0.25000000 1.0