# generated using pymatgen data_RbCoBr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.91575753 _cell_length_b 12.91575753 _cell_length_c 6.24363700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999762 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbCoBr3 _chemical_formula_sum 'Rb6 Co6 Br18' _cell_volume 902.00315104 _cell_formula_units_Z 6 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 Rb Rb0 1 0.33437300 0.33317700 0.26970300 1.0 Rb Rb1 1 0.66682300 0.00119600 0.26970300 1.0 Rb Rb2 1 0.66682300 0.66562700 0.76970300 1.0 Rb Rb3 1 0.99880400 0.66562700 0.26970300 1.0 Rb Rb4 1 0.99880400 0.33317700 0.76970300 1.0 Rb Rb5 1 0.33437300 0.00119600 0.76970300 1.0 Co Co6 1 0.33333300 0.66666700 0.05096100 1.0 Co Co7 1 0.33333300 0.66666700 0.55096100 1.0 Co Co8 1 0.66666700 0.33333300 0.00698100 1.0 Co Co9 1 0.66666700 0.33333300 0.50698100 1.0 Co Co10 1 0.00000000 0.00000000 0.99174900 1.0 Co Co11 1 0.00000000 0.00000000 0.49174900 1.0 Br Br12 1 0.00030500 0.15849600 0.24112400 1.0 Br Br13 1 0.84150400 0.84180900 0.24112400 1.0 Br Br14 1 0.84150400 0.99969500 0.74112400 1.0 Br Br15 1 0.15819100 0.99969500 0.24112400 1.0 Br Br16 1 0.15819100 0.15849600 0.74112400 1.0 Br Br17 1 0.00030500 0.84180900 0.74112400 1.0 Br Br18 1 0.17415100 0.50747400 0.30275400 1.0 Br Br19 1 0.49252600 0.66667700 0.30275400 1.0 Br Br20 1 0.49252600 0.82584900 0.80275400 1.0 Br Br21 1 0.33332300 0.82584900 0.30275400 1.0 Br Br22 1 0.33332300 0.50747400 0.80275400 1.0 Br Br23 1 0.17415100 0.66667700 0.80275400 1.0 Br Br24 1 0.50766700 0.17386800 0.25718900 1.0 Br Br25 1 0.82613200 0.33379900 0.25718900 1.0 Br Br26 1 0.82613200 0.49233300 0.75718900 1.0 Br Br27 1 0.66620100 0.49233300 0.25718900 1.0 Br Br28 1 0.66620100 0.17386800 0.75718900 1.0 Br Br29 1 0.50766700 0.33379900 0.75718900 1.0