# generated using pymatgen data_Ba4PrSm(Cu3O7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.88834400 _cell_length_b 3.95962400 _cell_length_c 23.86918500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4PrSm(Cu3O7)2 _chemical_formula_sum 'Ba4 Pr1 Sm1 Cu6 O14' _cell_volume 367.49904786 _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 0.50000000 0.50000000 0.83999000 1.0 Ba Ba1 1 0.50000000 0.50000000 0.33969400 1.0 Ba Ba2 1 0.50000000 0.50000000 0.16001000 1.0 Ba Ba3 1 0.50000000 0.50000000 0.66030600 1.0 Pr Pr4 1 0.50000000 0.50000000 0.50000000 1.0 Sm Sm5 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu6 1 0.00000000 0.00000000 0.75011100 1.0 Cu Cu7 1 0.00000000 0.00000000 0.24988900 1.0 Cu Cu8 1 0.00000000 0.00000000 0.92406700 1.0 Cu Cu9 1 0.00000000 0.00000000 0.42292500 1.0 Cu Cu10 1 0.00000000 0.00000000 0.07593300 1.0 Cu Cu11 1 0.00000000 0.00000000 0.57707500 1.0 O O12 1 0.00000000 0.50000000 0.75020400 1.0 O O13 1 0.00000000 0.50000000 0.24979600 1.0 O O14 1 0.00000000 0.50000000 0.93716800 1.0 O O15 1 0.00000000 0.50000000 0.43484600 1.0 O O16 1 0.00000000 0.50000000 0.06283200 1.0 O O17 1 0.00000000 0.50000000 0.56515400 1.0 O O18 1 0.00000000 0.00000000 0.82913600 1.0 O O19 1 0.00000000 0.00000000 0.32875200 1.0 O O20 1 0.00000000 0.00000000 0.17086400 1.0 O O21 1 0.00000000 0.00000000 0.67124800 1.0 O O22 1 0.50000000 0.00000000 0.93766900 1.0 O O23 1 0.50000000 0.00000000 0.43538500 1.0 O O24 1 0.50000000 0.00000000 0.06233100 1.0 O O25 1 0.50000000 0.00000000 0.56461500 1.0