# generated using pymatgen data_Nb3Cu2SnN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.32338603 _cell_length_b 8.32338680 _cell_length_c 8.32338603 _cell_angle_alpha 120.00000086 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000086 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3Cu2SnN _chemical_formula_sum 'Nb12 Cu8 Sn4 N4' _cell_volume 407.74171303 _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 Nb Nb0 1 0.30592800 0.75000100 0.19407200 1.0 Nb Nb1 1 0.94407300 0.38814400 0.19407200 1.0 Nb Nb2 1 0.94407300 0.75000100 0.19407200 1.0 Nb Nb3 1 0.69407300 0.88814400 0.44407200 1.0 Nb Nb4 1 0.69407300 0.25000100 0.44407200 1.0 Nb Nb5 1 0.05592900 0.25000100 0.44407300 1.0 Nb Nb6 1 0.30592800 0.11185600 0.55592900 1.0 Nb Nb7 1 0.30592800 0.75000100 0.55592900 1.0 Nb Nb8 1 0.94407300 0.75000100 0.55592900 1.0 Nb Nb9 1 0.69407300 0.25000100 0.80592900 1.0 Nb Nb10 1 0.05592800 0.61185600 0.80592900 1.0 Nb Nb11 1 0.05592800 0.25000100 0.80592900 1.0 Cu Cu12 1 0.70938728 0.91877256 0.12816085 1.0 Cu Cu13 1 0.29061272 0.08122644 0.20938728 1.0 Cu Cu14 1 0.29061272 0.41877356 0.20938728 1.0 Cu Cu15 1 0.62816085 0.41877356 0.20938728 1.0 Cu Cu16 1 0.70938728 0.58122644 0.79061272 1.0 Cu Cu17 1 0.70938728 0.91877256 0.79061272 1.0 Cu Cu18 1 0.37183915 0.58122644 0.79061272 1.0 Cu Cu19 1 0.29061272 0.08122644 0.87183915 1.0 Sn Sn20 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn21 1 0.50000000 0.00000000 0.00000000 1.0 Sn Sn22 1 0.50000000 0.50000000 0.00000000 1.0 Sn Sn23 1 0.50000000 0.50000000 0.50000000 1.0 N N24 1 0.00000000 0.50000000 0.00000000 1.0 N N25 1 0.00000000 0.00000000 0.50000000 1.0 N N26 1 0.50000000 0.00000000 0.50000000 1.0 N N27 1 0.00000000 0.50000000 0.50000000 1.0