# generated using pymatgen data_Cs12GaGeAs6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.69347140 _cell_length_b 13.58325908 _cell_length_c 13.66664975 _cell_angle_alpha 60.17621009 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs12GaGeAs6 _chemical_formula_sum 'Cs12 Ga1 Ge1 As6' _cell_volume 916.94276139 _cell_formula_units_Z 1 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 0.75000000 0.48125726 0.11954629 1.0 Cs Cs1 1 0.25000000 0.51242313 0.88627748 1.0 Cs Cs2 1 0.75000000 0.72088951 0.23774379 1.0 Cs Cs3 1 0.25000000 0.27665923 0.76079929 1.0 Cs Cs4 1 0.25000000 0.59884493 0.51484142 1.0 Cs Cs5 1 0.75000000 0.40141943 0.47863578 1.0 Cs Cs6 1 0.25000000 0.76180820 0.96083284 1.0 Cs Cs7 1 0.75000000 0.23730241 0.04277544 1.0 Cs Cs8 1 0.25000000 0.88439532 0.60256650 1.0 Cs Cs9 1 0.75000000 0.12140737 0.39765247 1.0 Cs Cs10 1 0.25000000 0.95959194 0.28149496 1.0 Cs Cs11 1 0.75000000 0.04423196 0.71545267 1.0 Ga Ga12 1 0.25000000 0.33500661 0.33191096 1.0 Ge Ge13 1 0.75000000 0.66515136 0.66814880 1.0 As As14 1 0.25000000 0.26347641 0.19816587 1.0 As As15 1 0.75000000 0.73051478 0.80100185 1.0 As As16 1 0.25000000 0.20040276 0.53614542 1.0 As As17 1 0.75000000 0.79831353 0.47077997 1.0 As As18 1 0.25000000 0.54040036 0.26215323 1.0 As As19 1 0.75000000 0.46650349 0.73307497 1.0