# generated using pymatgen data_NpCuSe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.35572900 _cell_length_b 6.60133500 _cell_length_c 7.09411860 _cell_angle_alpha 82.82508754 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NpCuSe2 _chemical_formula_sum 'Np4 Cu4 Se8' _cell_volume 341.77618981 _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 Np Np0 1 0.95110600 0.30737500 0.79639900 1.0 Np Np1 1 0.54889400 0.30737500 0.29639900 1.0 Np Np2 1 0.04889400 0.69262500 0.20360100 1.0 Np Np3 1 0.45110600 0.69262500 0.70360100 1.0 Cu Cu4 1 0.33750500 0.06404500 0.96157000 1.0 Cu Cu5 1 0.83750500 0.93595500 0.53843000 1.0 Cu Cu6 1 0.66249500 0.93595500 0.03843000 1.0 Cu Cu7 1 0.16249500 0.06404500 0.46157000 1.0 Se Se8 1 0.77066700 0.58327300 0.49821100 1.0 Se Se9 1 0.60947100 0.10202600 0.71188400 1.0 Se Se10 1 0.27066700 0.41672700 0.00178900 1.0 Se Se11 1 0.22933300 0.41672700 0.50178900 1.0 Se Se12 1 0.39052900 0.89797400 0.28811600 1.0 Se Se13 1 0.10947100 0.89797400 0.78811600 1.0 Se Se14 1 0.89052900 0.10202600 0.21188400 1.0 Se Se15 1 0.72933300 0.58327300 0.99821100 1.0