# generated using pymatgen data_Gd2Fe14B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.73368158 _cell_length_b 8.73368158 _cell_length_c 11.95667574 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Gd2Fe14B _chemical_formula_sum 'Gd8 Fe56 B4' _cell_volume 912.02167431 _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 Gd Gd0 1 0.23548292 0.76451708 0.50000000 1.0 Gd Gd1 1 0.76451708 0.23548292 0.50000000 1.0 Gd Gd2 1 0.26451708 0.26451708 -0.00000000 1.0 Gd Gd3 1 0.73548292 0.73548292 -0.00000000 1.0 Gd Gd4 1 0.64316660 0.64316660 0.50000000 1.0 Gd Gd5 1 0.35683340 0.35683340 0.50000000 1.0 Gd Gd6 1 0.85683340 0.14316660 -0.00000000 1.0 Gd Gd7 1 0.14316660 0.85683340 -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 0.11483592 1.0 Fe Fe13 1 -0.00000000 0.00000000 0.61483592 1.0 Fe Fe14 1 0.50000000 0.50000000 0.88516408 1.0 Fe Fe15 1 -0.00000000 0.00000000 0.38516408 1.0 Fe Fe16 1 0.18359777 0.81640223 0.25390065 1.0 Fe Fe17 1 0.81640223 0.18359777 0.25390065 1.0 Fe Fe18 1 0.31640223 0.31640223 0.75390065 1.0 Fe Fe19 1 0.68359777 0.68359777 0.75390065 1.0 Fe Fe20 1 0.81640223 0.18359777 0.74609935 1.0 Fe Fe21 1 0.18359777 0.81640223 0.74609935 1.0 Fe Fe22 1 0.68359777 0.68359777 0.24609935 1.0 Fe Fe23 1 0.31640223 0.31640223 0.24609935 1.0 Fe Fe24 1 0.40268900 0.59731100 0.29823518 1.0 Fe Fe25 1 0.59731100 0.40268900 0.29823518 1.0 Fe Fe26 1 0.09731100 0.09731100 0.79823518 1.0 Fe Fe27 1 0.90268900 0.90268900 0.79823518 1.0 Fe Fe28 1 0.59731100 0.40268900 0.70176482 1.0 Fe Fe29 1 0.40268900 0.59731100 0.70176482 1.0 Fe Fe30 1 0.90268900 0.90268900 0.20176482 1.0 Fe Fe31 1 0.09731100 0.09731100 0.20176482 1.0 Fe Fe32 1 0.14129363 0.53618770 0.32475272 1.0 Fe Fe33 1 0.85870637 0.46381230 0.32475272 1.0 Fe Fe34 1 0.35870637 0.03618770 0.82475272 1.0 Fe Fe35 1 0.64129363 0.96381230 0.82475272 1.0 Fe Fe36 1 0.85870637 0.46381230 0.67524728 1.0 Fe Fe37 1 0.14129363 0.53618770 0.67524728 1.0 Fe Fe38 1 0.64129363 0.96381230 0.17524728 1.0 Fe Fe39 1 0.35870637 0.03618770 0.17524728 1.0 Fe Fe40 1 0.53618770 0.14129363 0.32475272 1.0 Fe Fe41 1 0.46381230 0.85870637 0.32475272 1.0 Fe Fe42 1 0.03618770 0.35870637 0.82475272 1.0 Fe Fe43 1 0.96381230 0.64129363 0.82475272 1.0 Fe Fe44 1 0.46381230 0.85870637 0.67524728 1.0 Fe Fe45 1 0.53618770 0.14129363 0.67524728 1.0 Fe Fe46 1 0.96381230 0.64129363 0.17524728 1.0 Fe Fe47 1 0.03618770 0.35870637 0.17524728 1.0 Fe Fe48 1 0.93449883 0.72531657 0.37361661 1.0 Fe Fe49 1 0.06550117 0.27468343 0.37361661 1.0 Fe Fe50 1 0.56550117 0.22531657 0.87361661 1.0 Fe Fe51 1 0.43449883 0.77468343 0.87361661 1.0 Fe Fe52 1 0.06550117 0.27468343 0.62638339 1.0 Fe Fe53 1 0.93449883 0.72531657 0.62638339 1.0 Fe Fe54 1 0.43449883 0.77468343 0.12638339 1.0 Fe Fe55 1 0.56550117 0.22531657 0.12638339 1.0 Fe Fe56 1 0.72531657 0.93449883 0.37361661 1.0 Fe Fe57 1 0.27468343 0.06550117 0.37361661 1.0 Fe Fe58 1 0.22531657 0.56550117 0.87361661 1.0 Fe Fe59 1 0.77468343 0.43449883 0.87361661 1.0 Fe Fe60 1 0.27468343 0.06550117 0.62638339 1.0 Fe Fe61 1 0.72531657 0.93449883 0.62638339 1.0 Fe Fe62 1 0.77468343 0.43449883 0.12638339 1.0 Fe Fe63 1 0.22531657 0.56550117 0.12638339 1.0 B B64 1 0.87458306 0.87458306 0.50000000 1.0 B B65 1 0.12541694 0.12541694 0.50000000 1.0 B B66 1 0.62541694 0.37458306 -0.00000000 1.0 B B67 1 0.37458306 0.62541694 -0.00000000 1.0