# generated using pymatgen data_HoScFeB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.42255256 _cell_length_b 8.88928135 _cell_length_c 11.24307148 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HoScFeB6 _chemical_formula_sum 'Ho4 Sc4 Fe4 B24' _cell_volume 342.05957403 _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 Ho Ho0 1 0.00000000 0.82199254 0.08524471 1.0 Ho Ho1 1 0.00000000 0.17800746 0.91475529 1.0 Ho Ho2 1 0.00000000 0.32199254 0.41475529 1.0 Ho Ho3 1 0.00000000 0.67800746 0.58524471 1.0 Sc Sc4 1 0.00000000 0.44422608 0.12850130 1.0 Sc Sc5 1 0.00000000 0.55577392 0.87149870 1.0 Sc Sc6 1 0.00000000 0.94422608 0.37149870 1.0 Sc Sc7 1 0.00000000 0.05577392 0.62850130 1.0 Fe Fe8 1 0.00000000 0.14071004 0.18172324 1.0 Fe Fe9 1 0.00000000 0.85928996 0.81827676 1.0 Fe Fe10 1 0.00000000 0.64071004 0.31827676 1.0 Fe Fe11 1 0.00000000 0.35928996 0.68172324 1.0 B B12 1 0.50000000 0.05593029 0.06894586 1.0 B B13 1 0.50000000 0.94406971 0.93105414 1.0 B B14 1 0.50000000 0.55593029 0.43105414 1.0 B B15 1 0.50000000 0.44406971 0.56894586 1.0 B B16 1 0.50000000 0.25090604 0.08304641 1.0 B B17 1 0.50000000 0.74909396 0.91695359 1.0 B B18 1 0.50000000 0.75090604 0.41695359 1.0 B B19 1 0.50000000 0.24909396 0.58304641 1.0 B B20 1 0.50000000 0.29219278 0.23468812 1.0 B B21 1 0.50000000 0.70780722 0.76531188 1.0 B B22 1 0.50000000 0.79219278 0.26531188 1.0 B B23 1 0.50000000 0.20780722 0.73468812 1.0 B B24 1 0.50000000 0.13021155 0.31600477 1.0 B B25 1 0.50000000 0.86978845 0.68399523 1.0 B B26 1 0.50000000 0.63021155 0.18399523 1.0 B B27 1 0.50000000 0.36978845 0.81600477 1.0 B B28 1 0.50000000 0.48485987 0.28635264 1.0 B B29 1 0.50000000 0.51514013 0.71364736 1.0 B B30 1 0.50000000 0.98485987 0.21364736 1.0 B B31 1 0.50000000 0.01514013 0.78635264 1.0 B B32 1 0.50000000 0.10055575 0.47302235 1.0 B B33 1 0.50000000 0.89944425 0.52697765 1.0 B B34 1 0.50000000 0.60055575 0.02697765 1.0 B B35 1 0.50000000 0.39944425 0.97302235 1.0