# generated using pymatgen data_Cs4NbSbBr12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.81468016 _cell_length_b 7.81468016 _cell_length_c 10.97569844 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs4NbSbBr12 _chemical_formula_sum 'Cs4 Nb1 Sb1 Br12' _cell_volume 670.27740807 _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 Cs Cs0 1 0.50000000 0.00000000 0.72951466 1.0 Cs Cs1 1 0.00000000 0.50000000 0.27048534 1.0 Cs Cs2 1 0.50000000 0.00000000 0.27048534 1.0 Cs Cs3 1 0.00000000 0.50000000 0.72951466 1.0 Nb Nb4 1 0.00000000 0.00000000 0.00000000 1.0 Sb Sb5 1 0.50000000 0.50000000 0.50000000 1.0 Br Br6 1 0.00000000 0.00000000 0.76778070 1.0 Br Br7 1 0.50000000 0.50000000 0.24413447 1.0 Br Br8 1 0.75334287 0.75334287 0.50000000 1.0 Br Br9 1 0.23080907 0.23080907 0.00000000 1.0 Br Br10 1 0.75334287 0.24665713 0.50000000 1.0 Br Br11 1 0.23080907 0.76919093 0.00000000 1.0 Br Br12 1 0.00000000 0.00000000 0.23221930 1.0 Br Br13 1 0.50000000 0.50000000 0.75586553 1.0 Br Br14 1 0.24665713 0.24665713 0.50000000 1.0 Br Br15 1 0.76919093 0.76919093 0.00000000 1.0 Br Br16 1 0.24665713 0.75334287 0.50000000 1.0 Br Br17 1 0.76919093 0.23080907 0.00000000 1.0