# generated using pymatgen data_Sm2Fe14B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.74772900 _cell_length_b 8.74772900 _cell_length_c 12.06148500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2Fe14B _chemical_formula_sum 'Sm8 Fe56 B4' _cell_volume 922.97815395 _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 Sm Sm0 1 0.23240500 0.76759500 0.50000000 1.0 Sm Sm1 1 0.76759500 0.23240500 0.50000000 1.0 Sm Sm2 1 0.26759500 0.26759500 0.00000000 1.0 Sm Sm3 1 0.73240500 0.73240500 0.00000000 1.0 Sm Sm4 1 0.64335600 0.64335600 0.50000000 1.0 Sm Sm5 1 0.35664400 0.35664400 0.50000000 1.0 Sm Sm6 1 0.85664400 0.14335600 0.00000000 1.0 Sm Sm7 1 0.14335600 0.85664400 0.00000000 1.0 Fe Fe8 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe9 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe10 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe11 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe12 1 0.50000000 0.50000000 0.11473600 1.0 Fe Fe13 1 0.00000000 0.00000000 0.61473600 1.0 Fe Fe14 1 0.50000000 0.50000000 0.88526400 1.0 Fe Fe15 1 0.00000000 0.00000000 0.38526400 1.0 Fe Fe16 1 0.18263500 0.81736500 0.25420200 1.0 Fe Fe17 1 0.81736500 0.18263500 0.25420200 1.0 Fe Fe18 1 0.31736500 0.31736500 0.75420200 1.0 Fe Fe19 1 0.68263500 0.68263500 0.75420200 1.0 Fe Fe20 1 0.81736500 0.18263500 0.74579800 1.0 Fe Fe21 1 0.18263500 0.81736500 0.74579800 1.0 Fe Fe22 1 0.68263500 0.68263500 0.24579800 1.0 Fe Fe23 1 0.31736500 0.31736500 0.24579800 1.0 Fe Fe24 1 0.40252000 0.59748000 0.29643000 1.0 Fe Fe25 1 0.59748000 0.40252000 0.29643000 1.0 Fe Fe26 1 0.09748000 0.09748000 0.79643000 1.0 Fe Fe27 1 0.90252000 0.90252000 0.79643000 1.0 Fe Fe28 1 0.59748000 0.40252000 0.70357000 1.0 Fe Fe29 1 0.40252000 0.59748000 0.70357000 1.0 Fe Fe30 1 0.90252000 0.90252000 0.20357000 1.0 Fe Fe31 1 0.09748000 0.09748000 0.20357000 1.0 Fe Fe32 1 0.14015900 0.53663900 0.32418500 1.0 Fe Fe33 1 0.85984100 0.46336100 0.32418500 1.0 Fe Fe34 1 0.35984100 0.03663900 0.82418500 1.0 Fe Fe35 1 0.64015900 0.96336100 0.82418500 1.0 Fe Fe36 1 0.85984100 0.46336100 0.67581500 1.0 Fe Fe37 1 0.14015900 0.53663900 0.67581500 1.0 Fe Fe38 1 0.64015900 0.96336100 0.17581500 1.0 Fe Fe39 1 0.35984100 0.03663900 0.17581500 1.0 Fe Fe40 1 0.53663900 0.14015900 0.32418500 1.0 Fe Fe41 1 0.46336100 0.85984100 0.32418500 1.0 Fe Fe42 1 0.03663900 0.35984100 0.82418500 1.0 Fe Fe43 1 0.96336100 0.64015900 0.82418500 1.0 Fe Fe44 1 0.46336100 0.85984100 0.67581500 1.0 Fe Fe45 1 0.53663900 0.14015900 0.67581500 1.0 Fe Fe46 1 0.96336100 0.64015900 0.17581500 1.0 Fe Fe47 1 0.03663900 0.35984100 0.17581500 1.0 Fe Fe48 1 0.93324500 0.72493200 0.37293700 1.0 Fe Fe49 1 0.06675500 0.27506800 0.37293700 1.0 Fe Fe50 1 0.56675500 0.22493200 0.87293700 1.0 Fe Fe51 1 0.43324500 0.77506800 0.87293700 1.0 Fe Fe52 1 0.06675500 0.27506800 0.62706300 1.0 Fe Fe53 1 0.93324500 0.72493200 0.62706300 1.0 Fe Fe54 1 0.43324500 0.77506800 0.12706300 1.0 Fe Fe55 1 0.56675500 0.22493200 0.12706300 1.0 Fe Fe56 1 0.72493200 0.93324500 0.37293700 1.0 Fe Fe57 1 0.27506800 0.06675500 0.37293700 1.0 Fe Fe58 1 0.22493200 0.56675500 0.87293700 1.0 Fe Fe59 1 0.77506800 0.43324500 0.87293700 1.0 Fe Fe60 1 0.27506800 0.06675500 0.62706300 1.0 Fe Fe61 1 0.72493200 0.93324500 0.62706300 1.0 Fe Fe62 1 0.77506800 0.43324500 0.12706300 1.0 Fe Fe63 1 0.22493200 0.56675500 0.12706300 1.0 B B64 1 0.87568100 0.87568100 0.50000000 1.0 B B65 1 0.12431900 0.12431900 0.50000000 1.0 B B66 1 0.62431900 0.37568100 0.00000000 1.0 B B67 1 0.37568100 0.62431900 0.00000000 1.0