# generated using pymatgen data_OsBr3O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.67589843 _cell_length_b 11.47499432 _cell_length_c 11.47611495 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.68772131 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural OsBr3O _chemical_formula_sum 'Os4 Br12 O4' _cell_volume 484.06582371 _cell_formula_units_Z 4 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 Os Os0 1 0.49689325 0.38298692 0.61728911 1.0 Os Os1 1 0.99689325 0.11701308 0.11728911 1.0 Os Os2 1 0.50310675 0.61701308 0.38271089 1.0 Os Os3 1 0.00310675 0.88298692 0.88271089 1.0 Br Br4 1 0.49401678 0.38870004 0.83162473 1.0 Br Br5 1 0.50598322 0.61129996 0.16837527 1.0 Br Br6 1 0.99401678 0.11129996 0.33162473 1.0 Br Br7 1 0.00598322 0.88870004 0.66837527 1.0 Br Br8 1 0.50459663 0.83122939 0.38821076 1.0 Br Br9 1 0.49540337 0.16877061 0.61178924 1.0 Br Br10 1 0.99540337 0.33122939 0.11178924 1.0 Br Br11 1 0.00459663 0.66877061 0.88821076 1.0 Br Br12 1 0.49934316 0.60645639 0.60607656 1.0 Br Br13 1 0.50065684 0.39354361 0.39392344 1.0 Br Br14 1 0.99934316 0.89354361 0.10607656 1.0 Br Br15 1 0.00065684 0.10645639 0.89392344 1.0 O O16 1 0.99698589 0.38499772 0.61527712 1.0 O O17 1 0.00301411 0.61500228 0.38472288 1.0 O O18 1 0.49698589 0.11500228 0.11527712 1.0 O O19 1 0.50301411 0.88499772 0.88472288 1.0