# generated using pymatgen data_Sm8GaSiBr12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.15730567 _cell_length_b 13.51349179 _cell_length_c 14.32590076 _cell_angle_alpha 89.84030843 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm8GaSiBr12 _chemical_formula_sum 'Sm8 Ga1 Si1 Br12' _cell_volume 804.82191174 _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 Sm Sm0 1 0.50000000 0.11985731 0.33873556 1.0 Sm Sm1 1 0.50000000 0.88014269 0.66126444 1.0 Sm Sm2 1 0.50000000 0.61745285 0.15888745 1.0 Sm Sm3 1 0.50000000 0.38254715 0.84111255 1.0 Sm Sm4 1 0.00000000 0.12203785 0.58071371 1.0 Sm Sm5 1 0.00000000 0.87796215 0.41928629 1.0 Sm Sm6 1 0.00000000 0.61845444 0.92157040 1.0 Sm Sm7 1 0.00000000 0.38154556 0.07842960 1.0 Ga Ga8 1 0.50000000 0.00000000 0.50000000 1.0 Si Si9 1 0.50000000 0.50000000 0.00000000 1.0 Br Br10 1 0.50000000 0.24622597 0.16366939 1.0 Br Br11 1 0.50000000 0.75377403 0.83633061 1.0 Br Br12 1 0.50000000 0.74434435 0.33402224 1.0 Br Br13 1 0.50000000 0.25565565 0.66597776 1.0 Br Br14 1 0.00000000 0.25464677 0.41088818 1.0 Br Br15 1 0.00000000 0.74535323 0.58911182 1.0 Br Br16 1 0.00000000 0.75369940 0.08866903 1.0 Br Br17 1 0.00000000 0.24630060 0.91133097 1.0 Br Br18 1 0.00000000 0.00193811 0.24395409 1.0 Br Br19 1 0.00000000 0.99806189 0.75604591 1.0 Br Br20 1 0.00000000 0.50093982 0.25579529 1.0 Br Br21 1 0.00000000 0.49906018 0.74420471 1.0