# generated using pymatgen data_Sm6GaGeBr6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.26207214 _cell_length_b 10.26207110 _cell_length_c 10.26158915 _cell_angle_alpha 109.46670074 _cell_angle_beta 109.46670777 _cell_angle_gamma 109.48215649 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm6GaGeBr6 _chemical_formula_sum 'Sm12 Ga2 Ge2 Br12' _cell_volume 831.86452794 _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 Sm Sm0 1 0.48095645 0.48972759 0.24076011 1.0 Sm Sm1 1 0.74896748 0.24019634 0.25923989 1.0 Sm Sm2 1 0.74893369 0.00868899 0.48959841 1.0 Sm Sm3 1 0.24066472 0.48091042 0.48959841 1.0 Sm Sm4 1 0.25980366 0.75103252 0.24076011 1.0 Sm Sm5 1 0.01908958 0.25933528 0.01040159 1.0 Sm Sm6 1 0.01027241 0.01904355 0.25923989 1.0 Sm Sm7 1 0.49131101 0.75106631 0.01040159 1.0 Sm Sm8 1 0.49091081 0.24091081 0.48182163 1.0 Sm Sm9 1 0.00998717 0.49001283 0.75000000 1.0 Sm Sm10 1 0.25908919 0.00908919 0.01817837 1.0 Sm Sm11 1 0.24001283 0.25998717 0.75000000 1.0 Ga Ga12 1 0.25009448 0.24990552 0.25000000 1.0 Ga Ga13 1 0.49990552 0.00009448 0.25000000 1.0 Ge Ge14 1 0.99994255 0.24994255 0.49988510 1.0 Ge Ge15 1 0.25005745 0.50005745 0.00011490 1.0 Br Br16 1 0.24947520 0.75452480 0.74363887 1.0 Br Br17 1 0.51088492 0.50583532 0.75636113 1.0 Br Br18 1 0.98703572 0.74249855 0.99310833 1.0 Br Br19 1 0.74547520 0.25052480 0.75636113 1.0 Br Br20 1 0.99416468 0.98911508 0.74363887 1.0 Br Br21 1 0.24939021 0.99392638 0.50689167 1.0 Br Br22 1 0.75750145 0.51296428 0.50689167 1.0 Br Br23 1 0.50607362 0.25060979 0.99310833 1.0 Br Br24 1 0.75606329 0.74393671 0.25000000 1.0 Br Br25 1 0.74413034 0.99413034 0.98826168 1.0 Br Br26 1 0.99393671 0.50606329 0.25000000 1.0 Br Br27 1 0.50586966 0.75586966 0.51173832 1.0