# generated using pymatgen data_NaH4ClO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.02363099 _cell_length_b 6.32961170 _cell_length_c 6.42943461 _cell_angle_alpha 64.47706021 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaH4ClO2 _chemical_formula_sum 'Na4 H16 Cl4 O8' _cell_volume 368.11218295 _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 Na Na0 1 0.83123677 0.01830404 0.54719842 1.0 Na Na1 1 0.33123677 0.98169596 0.95280158 1.0 Na Na2 1 0.16876323 0.98169596 0.45280158 1.0 Na Na3 1 0.66876323 0.01830404 0.04719842 1.0 H H4 1 0.58619739 0.77596209 0.78109179 1.0 H H5 1 0.08619739 0.22403791 0.71890821 1.0 H H6 1 0.41380261 0.22403791 0.21890821 1.0 H H7 1 0.91380261 0.77596209 0.28109179 1.0 H H8 1 0.69430809 0.62757549 0.94908181 1.0 H H9 1 0.19430809 0.37242451 0.55091819 1.0 H H10 1 0.30569191 0.37242451 0.05091819 1.0 H H11 1 0.80569191 0.62757549 0.44908181 1.0 H H12 1 0.47807403 0.38595358 0.74403260 1.0 H H13 1 0.97807403 0.61404642 0.75596740 1.0 H H14 1 0.52192597 0.61404642 0.25596740 1.0 H H15 1 0.02192597 0.38595358 0.24403260 1.0 H H16 1 0.54220375 0.25381760 0.61167585 1.0 H H17 1 0.04220375 0.74618240 0.88832415 1.0 H H18 1 0.45779625 0.74618240 0.38832415 1.0 H H19 1 0.95779625 0.25381760 0.11167585 1.0 Cl Cl20 1 0.87818980 0.29278606 0.78247450 1.0 Cl Cl21 1 0.37818980 0.70721394 0.71752550 1.0 Cl Cl22 1 0.12181020 0.70721394 0.21752550 1.0 Cl Cl23 1 0.62181020 0.29278606 0.28247450 1.0 O O24 1 0.67736919 0.78531299 0.83120880 1.0 O O25 1 0.17736919 0.21468701 0.66879120 1.0 O O26 1 0.32263081 0.21468701 0.16879120 1.0 O O27 1 0.82263081 0.78531299 0.33120880 1.0 O O28 1 0.50957256 0.23277745 0.76271028 1.0 O O29 1 0.00957256 0.76722255 0.73728972 1.0 O O30 1 0.49042744 0.76722255 0.23728972 1.0 O O31 1 0.99042744 0.23277745 0.26271028 1.0