# generated using pymatgen data_ZrMnN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.16039524 _cell_length_b 4.96450893 _cell_length_c 13.84834211 _cell_angle_alpha 21.83121617 _cell_angle_beta 90.43744598 _cell_angle_gamma 71.64291433 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrMnN2 _chemical_formula_sum 'Zr1 Mn1 N2' _cell_volume 40.40522541 _cell_formula_units_Z 1 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 0.99996400 0.00001900 0.49999700 1.0 Mn Mn1 1 0.00010300 0.99981300 0.00001900 1.0 N N2 1 0.00183000 0.99802100 0.26009500 1.0 N N3 1 0.99810300 0.00204600 0.73989000 1.0