# generated using pymatgen data_La2MoN3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.25050791 _cell_length_b 6.25050830 _cell_length_c 12.42287878 _cell_angle_alpha 87.61417303 _cell_angle_beta 87.61417397 _cell_angle_gamma 128.06512339 _symmetry_Int_Tables_number 1 _chemical_formula_structural La2MoN3 _chemical_formula_sum 'La8 Mo4 N12' _cell_volume 380.38838649 _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 La La0 1 0.97900357 0.58177820 0.85754107 1.0 La La1 1 0.41822180 0.02099643 0.64245893 1.0 La La2 1 0.65998695 0.87944775 0.92552200 1.0 La La3 1 0.12055225 0.34001305 0.57447800 1.0 La La4 1 0.02099643 0.41822180 0.14245893 1.0 La La5 1 0.87944775 0.65998695 0.42552200 1.0 La La6 1 0.58177820 0.97900357 0.35754107 1.0 La La7 1 0.34001305 0.12055225 0.07447800 1.0 Mo Mo8 1 0.70992097 0.70084717 0.67459546 1.0 Mo Mo9 1 0.29915283 0.29007903 0.82540454 1.0 Mo Mo10 1 0.70084717 0.70992097 0.17459546 1.0 Mo Mo11 1 0.29007903 0.29915283 0.32540454 1.0 N N12 1 0.15547659 0.34262497 0.95739079 1.0 N N13 1 0.99537164 0.00462836 0.25000000 1.0 N N14 1 0.00462836 0.99537164 0.75000000 1.0 N N15 1 0.36626497 0.63373503 0.75000000 1.0 N N16 1 0.63373503 0.36626497 0.25000000 1.0 N N17 1 0.65737503 0.84452341 0.54260921 1.0 N N18 1 0.84452341 0.65737503 0.04260921 1.0 N N19 1 0.12931081 0.47012531 0.37313625 1.0 N N20 1 0.47012531 0.12931081 0.87313625 1.0 N N21 1 0.87068919 0.52987469 0.62686375 1.0 N N22 1 0.34262497 0.15547659 0.45739079 1.0 N N23 1 0.52987469 0.87068919 0.12686375 1.0