# generated using pymatgen data_Sr2AlCu3O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.35995263 _cell_length_b 5.29921982 _cell_length_c 12.11720816 _cell_angle_alpha 102.61498327 _cell_angle_beta 102.70095406 _cell_angle_gamma 90.04891303 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2AlCu3O7 _chemical_formula_sum 'Sr4 Al2 Cu6 O14' _cell_volume 327.21320475 _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 Sr Sr0 1 0.33280000 0.34708400 0.69798600 1.0 Sr Sr1 1 0.63749500 0.65945500 0.30285200 1.0 Sr Sr2 1 0.83202800 0.85590700 0.69759900 1.0 Sr Sr3 1 0.13878700 0.15301000 0.30223300 1.0 Al Al4 1 0.98762300 0.00203300 0.00009400 1.0 Al Al5 1 0.48403800 0.49272100 0.00069800 1.0 Cu Cu6 1 0.25939800 0.69553100 0.50029100 1.0 Cu Cu7 1 0.76041300 0.30728800 0.50023100 1.0 Cu Cu8 1 0.92183300 0.44131200 0.88052900 1.0 Cu Cu9 1 0.04660700 0.56291900 0.11996700 1.0 Cu Cu10 1 0.42252100 0.93712700 0.88087500 1.0 Cu Cu11 1 0.54917600 0.06062900 0.12038500 1.0 O O12 1 0.10493100 0.35547000 0.50008600 1.0 O O13 1 0.60306200 0.63982400 0.50020900 1.0 O O14 1 0.24960700 0.26528300 0.88996900 1.0 O O15 1 0.36335500 0.73352800 0.10766600 1.0 O O16 1 0.74909500 0.12443800 0.89315700 1.0 O O17 1 0.86808100 0.88223300 0.11056700 1.0 O O18 1 0.60425600 0.62179800 0.89275800 1.0 O O19 1 0.71997700 0.38109200 0.11152700 1.0 O O20 1 0.10237700 0.76923800 0.88933400 1.0 O O21 1 0.22137200 0.23556400 0.10773700 1.0 O O22 1 0.31131500 0.83294500 0.66098400 1.0 O O23 1 0.65165700 0.16947500 0.33888000 1.0 O O24 1 0.81052100 0.32906800 0.66117400 1.0 O O25 1 0.15231800 0.67328900 0.33950000 1.0