# generated using pymatgen data_Pr4C4Br3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.27204532 _cell_length_b 11.15070649 _cell_length_c 11.30347587 _cell_angle_alpha 102.67240318 _cell_angle_beta 89.63708521 _cell_angle_gamma 95.02076239 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr4C4Br3 _chemical_formula_sum 'Pr8 C8 Br6' _cell_volume 523.27786483 _cell_formula_units_Z 2 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 Pr Pr0 1 0.62033123 0.17289272 0.02089191 1.0 Pr Pr1 1 0.23274456 0.36437296 0.83054374 1.0 Pr Pr2 1 0.37966877 0.82710728 0.97910809 1.0 Pr Pr3 1 0.62404045 0.17636788 0.56309694 1.0 Pr Pr4 1 0.98010059 0.97840094 0.24342178 1.0 Pr Pr5 1 0.01989941 0.02159906 0.75657822 1.0 Pr Pr6 1 0.76725544 0.63562704 0.16945626 1.0 Pr Pr7 1 0.37595955 0.82363212 0.43690306 1.0 C C8 1 0.50790467 0.84531969 0.21293159 1.0 C C9 1 0.87273339 0.96102740 0.99554660 1.0 C C10 1 0.24793754 0.76323345 0.19236916 1.0 C C11 1 0.12726661 0.03897260 0.00445340 1.0 C C12 1 0.12597599 0.03730043 0.51787578 1.0 C C13 1 0.87402401 0.96269957 0.48212422 1.0 C C14 1 0.75206246 0.23676655 0.80763084 1.0 C C15 1 0.49209533 0.15468031 0.78706841 1.0 Br Br16 1 0.19785072 0.38864998 0.57867536 1.0 Br Br17 1 0.20604766 0.40372822 0.10800836 1.0 Br Br18 1 0.79395234 0.59627178 0.89199164 1.0 Br Br19 1 0.58235957 0.20377526 0.29663240 1.0 Br Br20 1 0.41764043 0.79622474 0.70336760 1.0 Br Br21 1 0.80214928 0.61135002 0.42132464 1.0