# generated using pymatgen data_ZrMoN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.04927371 _cell_length_b 5.51553150 _cell_length_c 10.49535246 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrMoN2 _chemical_formula_sum 'Zr4 Mo4 N8' _cell_volume 176.51467052 _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 Zr Zr0 1 0.25000000 0.08648157 0.84836403 1.0 Zr Zr1 1 0.25000000 0.58648157 0.65163597 1.0 Zr Zr2 1 0.75000000 0.91351843 0.15163597 1.0 Zr Zr3 1 0.75000000 0.41351843 0.34836403 1.0 Mo Mo4 1 0.25000000 0.43042500 0.09371287 1.0 Mo Mo5 1 0.25000000 0.93042500 0.40628713 1.0 Mo Mo6 1 0.75000000 0.56957500 0.90628713 1.0 Mo Mo7 1 0.75000000 0.06957500 0.59371287 1.0 N N8 1 0.25000000 0.16222094 0.24592603 1.0 N N9 1 0.25000000 0.66222094 0.25407397 1.0 N N10 1 0.75000000 0.83777906 0.75407397 1.0 N N11 1 0.75000000 0.33777906 0.74592603 1.0 N N12 1 0.25000000 0.77671997 0.99971902 1.0 N N13 1 0.25000000 0.27671997 0.50028098 1.0 N N14 1 0.75000000 0.22328003 0.00028098 1.0 N N15 1 0.75000000 0.72328003 0.49971902 1.0