# generated using pymatgen data_Pr12Co(AsBr4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.46454705 _cell_length_b 10.46454698 _cell_length_c 10.46454684 _cell_angle_alpha 109.64507276 _cell_angle_beta 109.64507403 _cell_angle_gamma 109.64506563 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr12Co(AsBr4)3 _chemical_formula_sum 'Pr12 Co1 As3 Br12' _cell_volume 876.41982300 _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 Pr Pr0 1 0.47371689 0.47711191 0.24647313 1.0 Pr Pr1 1 0.75000000 0.23956027 0.26043973 1.0 Pr Pr2 1 0.75000000 0.01057178 0.48942822 1.0 Pr Pr3 1 0.24647313 0.47371689 0.47711191 1.0 Pr Pr4 1 0.26043973 0.75000000 0.23956027 1.0 Pr Pr5 1 0.02628311 0.25352687 0.02288809 1.0 Pr Pr6 1 0.02288809 0.02628311 0.25352687 1.0 Pr Pr7 1 0.48942822 0.75000000 0.01057178 1.0 Pr Pr8 1 0.47711191 0.24647313 0.47371689 1.0 Pr Pr9 1 0.01057178 0.48942822 0.75000000 1.0 Pr Pr10 1 0.25352687 0.02288809 0.02628311 1.0 Pr Pr11 1 0.23956027 0.26043973 0.75000000 1.0 Co Co12 1 0.25000000 0.25000000 0.25000000 1.0 As As13 1 0.49828709 0.00171291 0.25000000 1.0 As As14 1 0.00171291 0.25000000 0.49828709 1.0 As As15 1 0.25000000 0.49828709 0.00171291 1.0 Br Br16 1 0.25000000 0.75226059 0.74773941 1.0 Br Br17 1 0.51370441 0.50808226 0.76212380 1.0 Br Br18 1 0.98629559 0.73787620 0.99191774 1.0 Br Br19 1 0.74773941 0.25000000 0.75226059 1.0 Br Br20 1 0.99191774 0.98629559 0.73787620 1.0 Br Br21 1 0.25000000 0.99390288 0.50609712 1.0 Br Br22 1 0.76212380 0.51370441 0.50808226 1.0 Br Br23 1 0.50609712 0.25000000 0.99390288 1.0 Br Br24 1 0.75226059 0.74773941 0.25000000 1.0 Br Br25 1 0.73787620 0.99191774 0.98629559 1.0 Br Br26 1 0.99390288 0.50609712 0.25000000 1.0 Br Br27 1 0.50808226 0.76212380 0.51370441 1.0