# generated using pymatgen data_Sm12Al5Fe14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.79784264 _cell_length_b 9.36363642 _cell_length_c 9.42718738 _cell_angle_alpha 119.80532970 _cell_angle_beta 89.55864339 _cell_angle_gamma 90.02236321 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm12Al5Fe14 _chemical_formula_sum 'Sm12 Al5 Fe14' _cell_volume 673.85397319 _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 0.12111000 0.34627400 0.17346300 1.0 Sm Sm1 1 0.12188900 0.82760300 0.17458100 1.0 Sm Sm2 1 0.12569800 0.82524800 0.65084400 1.0 Sm Sm3 1 0.87889000 0.65372600 0.82653700 1.0 Sm Sm4 1 0.87811100 0.17239700 0.82541900 1.0 Sm Sm5 1 0.87430200 0.17475200 0.34915600 1.0 Sm Sm6 1 0.66704900 0.54246100 0.46198800 1.0 Sm Sm7 1 0.66695900 0.53821400 0.07841300 1.0 Sm Sm8 1 0.66654600 0.92053000 0.45768800 1.0 Sm Sm9 1 0.33295100 0.45753900 0.53801200 1.0 Sm Sm10 1 0.33304100 0.46178600 0.92158700 1.0 Sm Sm11 1 0.33345400 0.07947000 0.54231200 1.0 Al Al12 1 0.38754100 0.66511200 0.33108100 1.0 Al Al13 1 0.61245900 0.33488800 0.66891900 1.0 Al Al14 1 0.00000000 0.50000000 0.50000000 1.0 Al Al15 1 0.00000000 0.50000000 0.00000000 1.0 Al Al16 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe17 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe18 1 0.46681000 0.31304300 0.15778300 1.0 Fe Fe19 1 0.46662400 0.84327200 0.15461500 1.0 Fe Fe20 1 0.46594500 0.84336200 0.68643200 1.0 Fe Fe21 1 0.53319000 0.68695700 0.84221700 1.0 Fe Fe22 1 0.53337600 0.15672800 0.84538500 1.0 Fe Fe23 1 0.53405500 0.15663800 0.31356800 1.0 Fe Fe24 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe25 1 0.28620600 0.09488500 0.18976100 1.0 Fe Fe26 1 0.28151100 0.81726000 0.90878500 1.0 Fe Fe27 1 0.28154900 0.09121600 0.90960500 1.0 Fe Fe28 1 0.71379400 0.90511500 0.81023900 1.0 Fe Fe29 1 0.71848900 0.18274000 0.09121500 1.0 Fe Fe30 1 0.71845100 0.90878400 0.09039500 1.0