# generated using pymatgen data_Y2Fe14B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.72578912 _cell_length_b 8.72577449 _cell_length_c 11.96796755 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00003881 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y2Fe14B _chemical_formula_sum 'Y8 Fe56 B4' _cell_volume 911.23229000 _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 Y Y0 1 0.73330697 0.26671464 -0.00000000 1.0 Y Y1 1 0.23330176 0.23333082 0.50000000 1.0 Y Y2 1 0.76669824 0.76666918 0.50000000 1.0 Y Y3 1 0.26669303 0.73328536 -0.00000000 1.0 Y Y4 1 0.85680826 0.85679343 -0.00000000 1.0 Y Y5 1 0.64319544 0.35682129 0.50000000 1.0 Y Y6 1 0.35680456 0.64317871 0.50000000 1.0 Y Y7 1 0.14319174 0.14320657 -0.00000000 1.0 Fe Fe8 1 0.13982465 0.46416028 0.32498894 1.0 Fe Fe9 1 0.86017535 0.53583972 0.32498894 1.0 Fe Fe10 1 0.46415531 0.13984315 0.67501159 1.0 Fe Fe11 1 0.96415748 0.36018792 0.82494585 1.0 Fe Fe12 1 0.03584252 0.63981208 0.82494585 1.0 Fe Fe13 1 0.36017267 0.96415412 0.17505597 1.0 Fe Fe14 1 0.63982733 0.03584588 0.17505597 1.0 Fe Fe15 1 0.53584469 0.86015685 0.67501159 1.0 Fe Fe16 1 0.86017535 0.53583972 0.67501106 1.0 Fe Fe17 1 0.13982465 0.46416028 0.67501106 1.0 Fe Fe18 1 0.53584469 0.86015685 0.32498841 1.0 Fe Fe19 1 0.03584252 0.63981208 0.17505415 1.0 Fe Fe20 1 0.96415748 0.36018792 0.17505415 1.0 Fe Fe21 1 0.63982733 0.03584588 0.82494403 1.0 Fe Fe22 1 0.36017267 0.96415412 0.82494403 1.0 Fe Fe23 1 0.46415531 0.13984315 0.32498841 1.0 Fe Fe24 1 0.06568279 0.72619246 0.37168495 1.0 Fe Fe25 1 0.93431721 0.27380754 0.37168495 1.0 Fe Fe26 1 0.72621646 0.06569335 0.62831884 1.0 Fe Fe27 1 0.22620360 0.43431797 0.87164755 1.0 Fe Fe28 1 0.77379640 0.56568203 0.87164755 1.0 Fe Fe29 1 0.43430668 0.22622389 0.12835705 1.0 Fe Fe30 1 0.56569332 0.77377611 0.12835705 1.0 Fe Fe31 1 0.27378354 0.93430665 0.62831884 1.0 Fe Fe32 1 0.93431721 0.27380754 0.62831505 1.0 Fe Fe33 1 0.06568279 0.72619246 0.62831505 1.0 Fe Fe34 1 0.27378354 0.93430665 0.37168116 1.0 Fe Fe35 1 0.77379640 0.56568203 0.12835245 1.0 Fe Fe36 1 0.22620360 0.43431797 0.12835245 1.0 Fe Fe37 1 0.56569332 0.77377611 0.87164295 1.0 Fe Fe38 1 0.43430668 0.22622389 0.87164295 1.0 Fe Fe39 1 0.72621646 0.06569335 0.37168116 1.0 Fe Fe40 1 0.59772152 0.59769604 0.70045956 1.0 Fe Fe41 1 0.40227848 0.40230396 0.70045956 1.0 Fe Fe42 1 0.59772152 0.59769604 0.29954044 1.0 Fe Fe43 1 0.09770400 0.90227298 0.20049853 1.0 Fe Fe44 1 0.90229600 0.09772702 0.20049853 1.0 Fe Fe45 1 0.90229600 0.09772702 0.79950147 1.0 Fe Fe46 1 0.09770400 0.90227298 0.79950147 1.0 Fe Fe47 1 0.40227848 0.40230396 0.29954044 1.0 Fe Fe48 1 0.81666933 0.81664056 0.74615837 1.0 Fe Fe49 1 0.18333067 0.18335944 0.74615837 1.0 Fe Fe50 1 0.81666933 0.81664056 0.25384163 1.0 Fe Fe51 1 0.31665493 0.68331791 0.24620116 1.0 Fe Fe52 1 0.68334507 0.31668209 0.24620116 1.0 Fe Fe53 1 0.68334507 0.31668209 0.75379884 1.0 Fe Fe54 1 0.31665493 0.68331791 0.75379884 1.0 Fe Fe55 1 0.18333067 0.18335944 0.25384163 1.0 Fe Fe56 1 -0.00000000 -0.00000000 0.61702542 1.0 Fe Fe57 1 0.50000000 0.50000000 0.11706410 1.0 Fe Fe58 1 0.50000000 0.50000000 0.88293590 1.0 Fe Fe59 1 -0.00000000 -0.00000000 0.38297458 1.0 Fe Fe60 1 0.50000000 -0.00000000 -0.00000000 1.0 Fe Fe61 1 0.50000000 -0.00000000 0.50000000 1.0 Fe Fe62 1 -0.00000000 0.50000000 0.50000000 1.0 Fe Fe63 1 -0.00000000 0.50000000 -0.00000000 1.0 B B64 1 0.62374831 0.62373640 -0.00000000 1.0 B B65 1 0.87625452 0.12375851 0.50000000 1.0 B B66 1 0.12374548 0.87624149 0.50000000 1.0 B B67 1 0.37625169 0.37626360 -0.00000000 1.0