# generated using pymatgen data_Ba2YbWN4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.74324212 _cell_length_b 10.43612726 _cell_length_c 8.08779861 _cell_angle_alpha 69.57633997 _cell_angle_beta 65.55351047 _cell_angle_gamma 44.87014410 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2YbWN4 _chemical_formula_sum 'Ba8 Yb4 W4 N16' _cell_volume 580.19460810 _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 Ba Ba0 1 0.57258347 0.92741653 0.92741653 1.0 Ba Ba1 1 0.92741653 0.57258347 0.57258347 1.0 Ba Ba2 1 0.32258347 0.67741653 0.67741653 1.0 Ba Ba3 1 0.11095107 0.11095107 0.88904893 1.0 Ba Ba4 1 0.13904893 0.13904893 0.36095107 1.0 Ba Ba5 1 0.36095107 0.36095107 0.13904893 1.0 Ba Ba6 1 0.67741653 0.32258347 0.32258347 1.0 Ba Ba7 1 0.88904893 0.88904893 0.11095107 1.0 Yb Yb8 1 0.33834981 0.33834981 0.66165019 1.0 Yb Yb9 1 0.91165019 0.91165019 0.58834981 1.0 Yb Yb10 1 0.66165019 0.66165019 0.33834981 1.0 Yb Yb11 1 0.58834981 0.58834981 0.91165019 1.0 W W12 1 0.49433769 0.00566231 0.49433769 1.0 W W13 1 0.00566231 0.49433769 0.00566231 1.0 W W14 1 0.75566231 0.24433769 0.75566231 1.0 W W15 1 0.24433769 0.75566231 0.24433769 1.0 N N16 1 0.01022908 0.66023404 0.81928729 1.0 N N17 1 0.69954828 0.28612174 0.99416062 1.0 N N18 1 0.66023404 0.01022908 0.51025059 1.0 N N19 1 0.51025059 0.81928729 0.66023404 1.0 N N20 1 0.23977092 0.58976596 0.43071271 1.0 N N21 1 0.73974941 0.43071271 0.58976596 1.0 N N22 1 0.99416062 0.02016836 0.69954828 1.0 N N23 1 0.55045172 0.96387826 0.25583938 1.0 N N24 1 0.43071271 0.73974941 0.23977092 1.0 N N25 1 0.96387826 0.55045172 0.22983164 1.0 N N26 1 0.28612174 0.69954828 0.02016836 1.0 N N27 1 0.81928729 0.51025059 0.01022908 1.0 N N28 1 0.22983164 0.25583938 0.96387826 1.0 N N29 1 0.58976596 0.23977092 0.73974941 1.0 N N30 1 0.25583938 0.22983164 0.55045172 1.0 N N31 1 0.02016836 0.99416062 0.28612174 1.0