# generated using pymatgen data_Ba4Sr(FeO3)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.67242775 _cell_length_b 5.67242704 _cell_length_c 20.64800376 _cell_angle_alpha 82.11899444 _cell_angle_beta 82.11897354 _cell_angle_gamma 90.02667605 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4Sr(FeO3)5 _chemical_formula_sum 'Ba8 Sr2 Fe10 O30' _cell_volume 651.76249654 _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 Ba Ba0 1 0.35127400 0.85131300 0.29725600 1.0 Ba Ba1 1 0.85131200 0.35127400 0.29725600 1.0 Ba Ba2 1 0.04814100 0.54814600 0.90376500 1.0 Ba Ba3 1 0.54814600 0.04814000 0.90376500 1.0 Ba Ba4 1 0.25036200 0.75036100 0.49923200 1.0 Ba Ba5 1 0.75035800 0.25036000 0.49923100 1.0 Ba Ba6 1 0.14999300 0.65002400 0.70013200 1.0 Ba Ba7 1 0.65002400 0.14999300 0.70013200 1.0 Sr Sr8 1 0.44995500 0.95009600 0.09994000 1.0 Sr Sr9 1 0.95009600 0.44995700 0.09994000 1.0 Fe Fe10 1 0.40161000 0.40160900 0.19665900 1.0 Fe Fe11 1 0.90126400 0.90127500 0.19719900 1.0 Fe Fe12 1 0.29956400 0.29956600 0.40079500 1.0 Fe Fe13 1 0.09993000 0.09992900 0.80048900 1.0 Fe Fe14 1 0.59715700 0.59715800 0.80542400 1.0 Fe Fe15 1 0.20036900 0.20038100 0.59950600 1.0 Fe Fe16 1 0.70020700 0.70020500 0.60015800 1.0 Fe Fe17 1 0.49899200 0.49898800 0.00219900 1.0 Fe Fe18 1 0.99838700 0.99839000 0.00329300 1.0 Fe Fe19 1 0.80106900 0.80105100 0.39756800 1.0 O O20 1 0.44792000 0.44792300 0.10345300 1.0 O O21 1 0.95020400 0.95020400 0.10023700 1.0 O O22 1 0.35446200 0.35446500 0.29086500 1.0 O O23 1 0.85366500 0.85366500 0.29323100 1.0 O O24 1 0.04611400 0.04611500 0.90705800 1.0 O O25 1 0.54797400 0.54797100 0.90463500 1.0 O O26 1 0.24891100 0.24891100 0.50154500 1.0 O O27 1 0.74859400 0.74859300 0.50268200 1.0 O O28 1 0.15021900 0.15022000 0.69922400 1.0 O O29 1 0.65313600 0.65313200 0.69398000 1.0 O O30 1 0.45246600 0.94831300 0.59952800 1.0 O O31 1 0.94831100 0.45246400 0.59952800 1.0 O O32 1 0.94771600 0.94771400 0.59943800 1.0 O O33 1 0.45294100 0.45294000 0.59953100 1.0 O O34 1 0.74480000 0.24768600 0.00748800 1.0 O O35 1 0.24768800 0.74480100 0.00748800 1.0 O O36 1 0.64930100 0.15708300 0.19361900 1.0 O O37 1 0.15708300 0.64930300 0.19361900 1.0 O O38 1 0.24752400 0.24752300 0.00716500 1.0 O O39 1 0.74511600 0.74511600 0.00748000 1.0 O O40 1 0.15441600 0.15441900 0.19351900 1.0 O O41 1 0.65213000 0.65213300 0.19346500 1.0 O O42 1 0.55060100 0.05174000 0.39744000 1.0 O O43 1 0.05174100 0.55059600 0.39744000 1.0 O O44 1 0.35106700 0.84721700 0.80186900 1.0 O O45 1 0.84721700 0.35106800 0.80186900 1.0 O O46 1 0.05185800 0.05185900 0.39746500 1.0 O O47 1 0.55047200 0.55047200 0.39743100 1.0 O O48 1 0.84721500 0.84721500 0.80187400 1.0 O O49 1 0.35092800 0.35092600 0.80189700 1.0