# generated using pymatgen data_Tm12In3Fe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.33333973 _cell_length_b 8.33333972 _cell_length_c 8.33333876 _cell_angle_alpha 109.83999501 _cell_angle_beta 109.83999681 _cell_angle_gamma 108.73615785 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm12In3Fe2 _chemical_formula_sum 'Tm12 In3 Fe2' _cell_volume 445.43240394 _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 Tm Tm0 1 0.30617911 0.30617911 0.61235823 1.0 Tm Tm1 1 0.69382089 0.69382089 0.38764177 1.0 Tm Tm2 1 0.30617911 0.69382089 0.00000000 1.0 Tm Tm3 1 0.69382089 0.30617911 1.00000000 1.0 Tm Tm4 1 0.45514385 0.20711770 0.24802615 1.0 Tm Tm5 1 0.54485615 0.79288230 0.75197385 1.0 Tm Tm6 1 0.95909056 0.20711770 0.75197385 1.0 Tm Tm7 1 0.20711770 0.95909056 0.75197385 1.0 Tm Tm8 1 0.04090944 0.79288230 0.24802615 1.0 Tm Tm9 1 0.79288230 0.04090944 0.24802615 1.0 Tm Tm10 1 0.20711770 0.45514385 0.24802615 1.0 Tm Tm11 1 0.79288230 0.54485615 0.75197385 1.0 In In12 1 0.00000000 0.00000000 0.00000000 1.0 In In13 1 0.50000000 0.00000000 0.50000000 1.0 In In14 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe15 1 0.38365842 0.38365842 1.00000000 1.0 Fe Fe16 1 0.61634158 0.61634158 0.00000000 1.0