# generated using pymatgen data_Cs2NpS3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.04867851 _cell_length_b 8.04867811 _cell_length_c 7.31850385 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 109.46489541 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs2NpS3 _chemical_formula_sum 'Cs4 Np2 S6' _cell_volume 447.00474353 _cell_formula_units_Z 2 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 Cs Cs0 1 0.49840017 0.81391227 0.25000000 1.0 Cs Cs1 1 0.50159983 0.18608773 0.75000000 1.0 Cs Cs2 1 0.18608773 0.50159983 0.75000000 1.0 Cs Cs3 1 0.81391227 0.49840017 0.25000000 1.0 Np Np4 1 0.08086637 0.08086637 0.25000000 1.0 Np Np5 1 0.91913363 0.91913363 0.75000000 1.0 S S6 1 0.64927751 0.64927751 0.75000000 1.0 S S7 1 0.35072249 0.35072249 0.25000000 1.0 S S8 1 0.86486563 0.13513437 0.50000000 1.0 S S9 1 0.86486563 0.13513437 0.00000000 1.0 S S10 1 0.13513437 0.86486563 0.50000000 1.0 S S11 1 0.13513437 0.86486563 0.00000000 1.0