# generated using pymatgen data_Sr2TaAlCu2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.47981800 _cell_length_b 5.64398069 _cell_length_c 12.33281792 _cell_angle_alpha 102.28088008 _cell_angle_beta 102.05675868 _cell_angle_gamma 92.47705612 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2TaAlCu2O7 _chemical_formula_sum 'Sr4 Ta2 Al2 Cu4 O14' _cell_volume 362.94297554 _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 0.65422000 0.61586300 0.27541400 1.0 Sr Sr1 1 0.36852300 0.38160400 0.72886300 1.0 Sr Sr2 1 0.15215100 0.16325200 0.27057400 1.0 Sr Sr3 1 0.87158000 0.84042500 0.72462200 1.0 Ta Ta4 1 0.69006300 0.16504200 0.50020100 1.0 Ta Ta5 1 0.27465200 0.83109200 0.50036500 1.0 Al Al6 1 0.01736300 0.01069000 0.99665500 1.0 Al Al7 1 0.49620800 0.48169400 0.00334900 1.0 Cu Cu8 1 0.06327500 0.56979800 0.10667400 1.0 Cu Cu9 1 0.94620900 0.44256200 0.89280000 1.0 Cu Cu10 1 0.57397500 0.04442400 0.10705600 1.0 Cu Cu11 1 0.45700900 0.93778200 0.89295800 1.0 O O12 1 0.92446600 0.90479200 0.50153300 1.0 O O13 1 0.32663400 0.19068400 0.49862100 1.0 O O14 1 0.74856500 0.38197800 0.10571500 1.0 O O15 1 0.62999800 0.61035400 0.89926700 1.0 O O16 1 0.26081700 0.23184600 0.10146400 1.0 O O17 1 0.13051000 0.77422400 0.89475400 1.0 O O18 1 0.39943700 0.71885800 0.11091400 1.0 O O19 1 0.26404800 0.26582600 0.88978600 1.0 O O20 1 0.89970300 0.89529100 0.10755100 1.0 O O21 1 0.77692300 0.10588500 0.88895500 1.0 O O22 1 0.68165000 0.21493900 0.35286800 1.0 O O23 1 0.37445500 0.75389900 0.64169600 1.0 O O24 1 0.23759800 0.61675700 0.35916700 1.0 O O25 1 0.82278700 0.36027700 0.64741200 1.0