# generated using pymatgen data_Na6MoN4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.52183300 _cell_length_b 7.52183300 _cell_length_c 5.81595500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na6MoN4 _chemical_formula_sum 'Na12 Mo2 N8' _cell_volume 329.05493728 _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 Na Na0 1 0.50000000 0.00000000 0.63741700 1.0 Na Na1 1 0.00000000 0.50000000 0.86258300 1.0 Na Na2 1 0.00000000 0.50000000 0.36258300 1.0 Na Na3 1 0.50000000 0.00000000 0.13741700 1.0 Na Na4 1 0.20639300 0.20639300 0.50000000 1.0 Na Na5 1 0.79360700 0.79360700 0.50000000 1.0 Na Na6 1 0.70639300 0.70639300 0.00000000 1.0 Na Na7 1 0.29360700 0.29360700 0.00000000 1.0 Na Na8 1 0.20639300 0.79360700 0.50000000 1.0 Na Na9 1 0.79360700 0.20639300 0.50000000 1.0 Na Na10 1 0.70639300 0.29360700 0.00000000 1.0 Na Na11 1 0.29360700 0.70639300 0.00000000 1.0 Mo Mo12 1 0.50000000 0.50000000 0.50000000 1.0 Mo Mo13 1 0.00000000 0.00000000 0.00000000 1.0 N N14 1 0.50000000 0.28461700 0.32482800 1.0 N N15 1 0.50000000 0.71538300 0.32482800 1.0 N N16 1 0.00000000 0.78461700 0.17517200 1.0 N N17 1 0.00000000 0.21538300 0.17517200 1.0 N N18 1 0.28461700 0.50000000 0.67517200 1.0 N N19 1 0.71538300 0.50000000 0.67517200 1.0 N N20 1 0.78461700 0.00000000 0.82482800 1.0 N N21 1 0.21538300 0.00000000 0.82482800 1.0