# generated using pymatgen data_Sr4Cr3O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.74735400 _cell_length_b 9.74735384 _cell_length_c 7.94132100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000054 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr4Cr3O9 _chemical_formula_sum 'Sr12 Cr9 O27' _cell_volume 653.42666200 _cell_formula_units_Z 3 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 Sr Sr0 1 0.69419200 0.66430900 0.00299000 1.0 Sr Sr1 1 0.02613400 0.69358600 0.75610700 1.0 Sr Sr2 1 0.34045300 0.34756800 0.25054200 1.0 Sr Sr3 1 0.65243200 0.99288500 0.25054200 1.0 Sr Sr4 1 0.66745200 0.97386600 0.75610700 1.0 Sr Sr5 1 0.00711500 0.65954700 0.25054200 1.0 Sr Sr6 1 0.33569100 0.02988300 0.00299000 1.0 Sr Sr7 1 0.97011700 0.30580800 0.00299000 1.0 Sr Sr8 1 0.35511400 0.99903700 0.51036700 1.0 Sr Sr9 1 0.30641400 0.33254800 0.75610700 1.0 Sr Sr10 1 0.00096300 0.35607700 0.51036700 1.0 Sr Sr11 1 0.64392300 0.64488600 0.51036700 1.0 Cr Cr12 1 0.00000000 0.00000000 0.86603400 1.0 Cr Cr13 1 0.66666700 0.33333300 0.42155900 1.0 Cr Cr14 1 0.33333300 0.66666700 0.33431300 1.0 Cr Cr15 1 0.66666700 0.33333300 0.76188800 1.0 Cr Cr16 1 0.00000000 0.00000000 0.19396100 1.0 Cr Cr17 1 0.33333300 0.66666700 0.65681500 1.0 Cr Cr18 1 0.00000000 0.00000000 0.52637000 1.0 Cr Cr19 1 0.66666700 0.33333300 0.09841300 1.0 Cr Cr20 1 0.33333300 0.66666700 0.99778300 1.0 O O21 1 0.67461400 0.49560100 0.26439200 1.0 O O22 1 0.17429500 0.67335300 0.49701400 1.0 O O23 1 0.82988100 0.87640000 0.34681100 1.0 O O24 1 0.04651900 0.17011900 0.34681100 1.0 O O25 1 0.83506000 0.47711200 0.93908800 1.0 O O26 1 0.15785800 0.16073500 0.02983700 1.0 O O27 1 0.34118200 0.82471800 0.82245800 1.0 O O28 1 0.33530400 0.82018900 0.16732900 1.0 O O29 1 0.00287700 0.84214200 0.02983700 1.0 O O30 1 0.50439900 0.17901300 0.26439200 1.0 O O31 1 0.52288800 0.35794900 0.93908800 1.0 O O32 1 0.12360000 0.95348100 0.34681100 1.0 O O33 1 0.64205100 0.16494000 0.93908800 1.0 O O34 1 0.17981100 0.51511500 0.16732900 1.0 O O35 1 0.83926500 0.99712300 0.02983700 1.0 O O36 1 0.49905900 0.82570500 0.49701400 1.0 O O37 1 0.48488500 0.66469600 0.16732900 1.0 O O38 1 0.85402400 0.83166400 0.70573900 1.0 O O39 1 0.50542000 0.31740100 0.57594900 1.0 O O40 1 0.97764000 0.14597600 0.70573900 1.0 O O41 1 0.81198100 0.49458000 0.57594900 1.0 O O42 1 0.82098700 0.32538600 0.26439200 1.0 O O43 1 0.17528200 0.51646400 0.82245800 1.0 O O44 1 0.48353600 0.65881800 0.82245800 1.0 O O45 1 0.68259900 0.18801900 0.57594900 1.0 O O46 1 0.32664700 0.50094100 0.49701400 1.0 O O47 1 0.16833600 0.02236000 0.70573900 1.0