# generated using pymatgen data_Cs2Pr10Ru2Br17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.55948610 _cell_length_b 11.21100404 _cell_length_c 11.20987524 _cell_angle_alpha 107.66173742 _cell_angle_beta 93.84063043 _cell_angle_gamma 93.84721443 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs2Pr10Ru2Br17 _chemical_formula_sum 'Cs2 Pr10 Ru2 Br17' _cell_volume 1137.34118851 _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 0.99480810 0.80887009 0.18113672 1.0 Cs Cs1 1 0.99465824 0.18113731 0.80881613 1.0 Pr Pr2 1 0.43565516 0.16185727 0.16186887 1.0 Pr Pr3 1 0.57385232 0.50927479 0.20436222 1.0 Pr Pr4 1 0.83115191 0.28904816 0.28899357 1.0 Pr Pr5 1 0.30632415 0.43742891 0.43742843 1.0 Pr Pr6 1 0.42621172 0.80434582 0.48621336 1.0 Pr Pr7 1 0.57387615 0.20437684 0.50927941 1.0 Pr Pr8 1 0.69281006 0.57071851 0.57073304 1.0 Pr Pr9 1 0.17556530 0.70951182 0.70957107 1.0 Pr Pr10 1 0.42618441 0.48623791 0.80441601 1.0 Pr Pr11 1 0.56348615 0.83520670 0.83522562 1.0 Ru Ru12 1 0.57097839 0.35794090 0.35794871 1.0 Ru Ru13 1 0.43131448 0.64293479 0.64296916 1.0 Br Br14 1 0.58399168 0.68668267 0.02475163 1.0 Br Br15 1 0.71270135 0.06640631 0.06608959 1.0 Br Br16 1 0.85736720 0.45008306 0.11918500 1.0 Br Br17 1 0.13285091 0.20884955 0.20877279 1.0 Br Br18 1 0.28283277 0.60458181 0.25387463 1.0 Br Br19 1 0.41700818 0.97841779 0.30981370 1.0 Br Br20 1 0.71749088 0.74711182 0.39706335 1.0 Br Br21 1 0.85739587 0.11907594 0.44977488 1.0 Br Br22 1 0.99950454 0.50105976 0.50111548 1.0 Br Br23 1 0.14136467 0.87973530 0.54688116 1.0 Br Br24 1 0.28283417 0.25392121 0.60462578 1.0 Br Br25 1 0.58411990 0.02459213 0.68657004 1.0 Br Br26 1 0.71740858 0.39706981 0.74712603 1.0 Br Br27 1 0.87029293 0.79418246 0.79431058 1.0 Br Br28 1 0.14126147 0.54678847 0.87970882 1.0 Br Br29 1 0.28787619 0.93276615 0.93292636 1.0 Br Br30 1 0.41682415 0.30978394 0.97845186 1.0