# generated using pymatgen data_DyThFe14B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.74896400 _cell_length_b 8.74896400 _cell_length_c 11.97176100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural DyThFe14B _chemical_formula_sum 'Dy4 Th4 Fe56 B4' _cell_volume 916.37091638 _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 Dy Dy0 1 0.22942100 0.77057900 0.50000000 1.0 Dy Dy1 1 0.77057900 0.22942100 0.50000000 1.0 Dy Dy2 1 0.27057900 0.27057900 0.00000000 1.0 Dy Dy3 1 0.72942100 0.72942100 0.00000000 1.0 Th Th4 1 0.64406800 0.64406800 0.50000000 1.0 Th Th5 1 0.35593200 0.35593200 0.50000000 1.0 Th Th6 1 0.85593200 0.14406800 0.00000000 1.0 Th Th7 1 0.14406800 0.85593200 0.00000000 1.0 Fe Fe8 1 0.18342100 0.81657900 0.25531800 1.0 Fe Fe9 1 0.81657900 0.18342100 0.25531800 1.0 Fe Fe10 1 0.31657900 0.31657900 0.75531800 1.0 Fe Fe11 1 0.68342100 0.68342100 0.75531800 1.0 Fe Fe12 1 0.81657900 0.18342100 0.74468200 1.0 Fe Fe13 1 0.18342100 0.81657900 0.74468200 1.0 Fe Fe14 1 0.68342100 0.68342100 0.24468200 1.0 Fe Fe15 1 0.31657900 0.31657900 0.24468200 1.0 Fe Fe16 1 0.93480900 0.72489800 0.37310500 1.0 Fe Fe17 1 0.06519100 0.27510200 0.37310500 1.0 Fe Fe18 1 0.56519100 0.22489800 0.87310500 1.0 Fe Fe19 1 0.43480900 0.77510200 0.87310500 1.0 Fe Fe20 1 0.06519100 0.27510200 0.62689500 1.0 Fe Fe21 1 0.93480900 0.72489800 0.62689500 1.0 Fe Fe22 1 0.43480900 0.77510200 0.12689500 1.0 Fe Fe23 1 0.56519100 0.22489800 0.12689500 1.0 Fe Fe24 1 0.72489800 0.93480900 0.37310500 1.0 Fe Fe25 1 0.27510200 0.06519100 0.37310500 1.0 Fe Fe26 1 0.22489800 0.56519100 0.87310500 1.0 Fe Fe27 1 0.77510200 0.43480900 0.87310500 1.0 Fe Fe28 1 0.27510200 0.06519100 0.62689500 1.0 Fe Fe29 1 0.72489800 0.93480900 0.62689500 1.0 Fe Fe30 1 0.77510200 0.43480900 0.12689500 1.0 Fe Fe31 1 0.22489800 0.56519100 0.12689500 1.0 Fe Fe32 1 0.50000000 0.50000000 0.11510200 1.0 Fe Fe33 1 0.00000000 0.00000000 0.61510200 1.0 Fe Fe34 1 0.50000000 0.50000000 0.88489800 1.0 Fe Fe35 1 0.00000000 0.00000000 0.38489800 1.0 Fe Fe36 1 0.14076500 0.53758500 0.32496000 1.0 Fe Fe37 1 0.85923500 0.46241500 0.32496000 1.0 Fe Fe38 1 0.35923500 0.03758500 0.82496000 1.0 Fe Fe39 1 0.64076500 0.96241500 0.82496000 1.0 Fe Fe40 1 0.85923500 0.46241500 0.67504000 1.0 Fe Fe41 1 0.14076500 0.53758500 0.67504000 1.0 Fe Fe42 1 0.64076500 0.96241500 0.17504000 1.0 Fe Fe43 1 0.35923500 0.03758500 0.17504000 1.0 Fe Fe44 1 0.53758500 0.14076500 0.32496000 1.0 Fe Fe45 1 0.46241500 0.85923500 0.32496000 1.0 Fe Fe46 1 0.03758500 0.35923500 0.82496000 1.0 Fe Fe47 1 0.96241500 0.64076500 0.82496000 1.0 Fe Fe48 1 0.46241500 0.85923500 0.67504000 1.0 Fe Fe49 1 0.53758500 0.14076500 0.67504000 1.0 Fe Fe50 1 0.96241500 0.64076500 0.17504000 1.0 Fe Fe51 1 0.03758500 0.35923500 0.17504000 1.0 Fe Fe52 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe53 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe54 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe55 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe56 1 0.40205400 0.59794600 0.29795500 1.0 Fe Fe57 1 0.59794600 0.40205400 0.29795500 1.0 Fe Fe58 1 0.09794600 0.09794600 0.79795500 1.0 Fe Fe59 1 0.90205400 0.90205400 0.79795500 1.0 Fe Fe60 1 0.59794600 0.40205400 0.70204500 1.0 Fe Fe61 1 0.40205400 0.59794600 0.70204500 1.0 Fe Fe62 1 0.90205400 0.90205400 0.20204500 1.0 Fe Fe63 1 0.09794600 0.09794600 0.20204500 1.0 B B64 1 0.87718700 0.87718700 0.50000000 1.0 B B65 1 0.12281300 0.12281300 0.50000000 1.0 B B66 1 0.62281300 0.37718700 0.00000000 1.0 B B67 1 0.37718700 0.62281300 0.00000000 1.0