# generated using pymatgen data_BaSrCoCu2(SO)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.97417100 _cell_length_b 3.97417100 _cell_length_c 10.03077972 _cell_angle_alpha 78.57419848 _cell_angle_beta 78.57419848 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaSrCoCu2(SO)2 _chemical_formula_sum 'Ba1 Sr1 Co1 Cu2 S2 O2' _cell_volume 152.08231215 _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 Ba Ba0 1 0.59721800 0.59721800 0.80556500 1.0 Sr Sr1 1 0.40658700 0.40658700 0.18682600 1.0 Co Co2 1 0.99534900 0.99534900 0.00930200 1.0 Cu Cu3 1 0.25232800 0.75232800 0.49534500 1.0 Cu Cu4 1 0.75232800 0.25232800 0.49534500 1.0 S S5 1 0.18113800 0.18113800 0.63772300 1.0 S S6 1 0.82529600 0.82529600 0.34940800 1.0 O O7 1 0.99487800 0.49487800 0.01024300 1.0 O O8 1 0.49487800 0.99487800 0.01024300 1.0