# generated using pymatgen data_SnCl3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.36499200 _cell_length_b 9.70600500 _cell_length_c 16.08853558 _cell_angle_alpha 58.00153250 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SnCl3O4 _chemical_formula_sum 'Sn4 Cl12 O16' _cell_volume 842.91276344 _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 Sn Sn0 1 0.52056000 0.83204600 0.48217000 1.0 Sn Sn1 1 0.97944000 0.83204600 0.98217000 1.0 Sn Sn2 1 0.47944000 0.16795400 0.51783000 1.0 Sn Sn3 1 0.02056000 0.16795400 0.01783000 1.0 Cl Cl4 1 0.37842600 0.93818500 0.32598000 1.0 Cl Cl5 1 0.12157400 0.93818500 0.82598000 1.0 Cl Cl6 1 0.62157400 0.06181500 0.67402000 1.0 Cl Cl7 1 0.87842600 0.06181500 0.17402000 1.0 Cl Cl8 1 0.86223900 0.73708000 0.48527100 1.0 Cl Cl9 1 0.63776100 0.73708000 0.98527100 1.0 Cl Cl10 1 0.13776100 0.26292000 0.51472900 1.0 Cl Cl11 1 0.36223900 0.26292000 0.01472900 1.0 Cl Cl12 1 0.35977100 0.57630300 0.58606000 1.0 Cl Cl13 1 0.14022900 0.57630300 0.08606000 1.0 Cl Cl14 1 0.64022900 0.42369700 0.41394000 1.0 Cl Cl15 1 0.85977100 0.42369700 0.91394000 1.0 O O16 1 0.66218200 0.04235200 0.46967400 1.0 O O17 1 0.83781800 0.04235200 0.96967400 1.0 O O18 1 0.33781800 0.95764800 0.53032600 1.0 O O19 1 0.16218200 0.95764800 0.03032600 1.0 O O20 1 0.54651900 0.70967400 0.70378000 1.0 O O21 1 0.95348100 0.70967400 0.20378000 1.0 O O22 1 0.45348100 0.29032600 0.29622000 1.0 O O23 1 0.04651900 0.29032600 0.79622000 1.0 O O24 1 0.79737800 0.26044700 0.29958000 1.0 O O25 1 0.70262200 0.26044700 0.79958000 1.0 O O26 1 0.20262200 0.73955300 0.70042000 1.0 O O27 1 0.29737800 0.73955300 0.20042000 1.0 O O28 1 0.62685100 0.31633300 0.24963200 1.0 O O29 1 0.87314900 0.31633300 0.74963200 1.0 O O30 1 0.37314900 0.68366700 0.75036800 1.0 O O31 1 0.12685100 0.68366700 0.25036800 1.0