# generated using pymatgen data_H6S2N2O3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.16796085 _cell_length_b 6.16796085 _cell_length_c 8.81707374 _cell_angle_alpha 87.42116587 _cell_angle_beta 87.42116587 _cell_angle_gamma 65.65670085 _symmetry_Int_Tables_number 1 _chemical_formula_structural H6S2N2O3 _chemical_formula_sum 'H12 S4 N4 O6' _cell_volume 305.17325025 _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 H H0 1 0.66448900 0.60217700 0.76201900 1.0 H H1 1 0.39782300 0.33551100 0.23798100 1.0 H H2 1 0.80005400 0.30762500 0.72282600 1.0 H H3 1 0.69237500 0.19994600 0.27717400 1.0 H H4 1 0.83316700 0.51772800 0.60300000 1.0 H H5 1 0.48227200 0.16683300 0.39700000 1.0 H H6 1 0.96280700 0.45573000 0.77632100 1.0 H H7 1 0.54427000 0.03719300 0.22367900 1.0 H H8 1 0.88950600 0.99072300 0.93687500 1.0 H H9 1 0.00927700 0.11049400 0.06312500 1.0 H H10 1 0.18117200 0.92796200 0.92373400 1.0 H H11 1 0.07203800 0.81882800 0.07626600 1.0 S S12 1 0.33070200 0.34814100 0.90760600 1.0 S S13 1 0.65185900 0.66929800 0.09239400 1.0 S S14 1 0.47398600 0.11581400 0.73306300 1.0 S S15 1 0.88418600 0.52601400 0.26693700 1.0 N N16 1 0.81656900 0.46931500 0.71655900 1.0 N N17 1 0.53068500 0.18343100 0.28344100 1.0 N N18 1 0.18579700 0.81420300 0.50000000 1.0 N N19 1 0.03768600 0.96231400 0.00000000 1.0 O O20 1 0.40194400 0.91579300 0.76924300 1.0 O O21 1 0.08420700 0.59805600 0.23075700 1.0 O O22 1 0.73713600 0.03444900 0.73879000 1.0 O O23 1 0.96555100 0.26286400 0.26121000 1.0 O O24 1 0.37853800 0.24159600 0.58983800 1.0 O O25 1 0.75840400 0.62146200 0.41016200 1.0