# generated using pymatgen data_NdHoReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.72413373 _cell_length_b 9.22984201 _cell_length_c 11.69213064 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdHoReB6 _chemical_formula_sum 'Nd4 Ho4 Re4 B24' _cell_volume 401.89554747 _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 Nd Nd0 1 0.00000000 0.32333209 0.41468089 1.0 Nd Nd1 1 0.00000000 0.67666791 0.58531911 1.0 Nd Nd2 1 0.00000000 0.82333209 0.08531911 1.0 Nd Nd3 1 0.00000000 0.17666791 0.91468089 1.0 Ho Ho4 1 0.00000000 0.94237081 0.36826995 1.0 Ho Ho5 1 0.00000000 0.05762919 0.63173005 1.0 Ho Ho6 1 0.00000000 0.44237081 0.13173005 1.0 Ho Ho7 1 0.00000000 0.55762919 0.86826995 1.0 Re Re8 1 0.00000000 0.63938005 0.31903295 1.0 Re Re9 1 0.00000000 0.36061995 0.68096705 1.0 Re Re10 1 0.00000000 0.13938005 0.18096705 1.0 Re Re11 1 0.00000000 0.86061995 0.81903295 1.0 B B12 1 0.50000000 0.55554587 0.43010722 1.0 B B13 1 0.50000000 0.44445413 0.56989278 1.0 B B14 1 0.50000000 0.05554587 0.06989278 1.0 B B15 1 0.50000000 0.94445413 0.93010722 1.0 B B16 1 0.50000000 0.75004872 0.41524497 1.0 B B17 1 0.50000000 0.24995128 0.58475503 1.0 B B18 1 0.50000000 0.25004872 0.08475503 1.0 B B19 1 0.50000000 0.74995128 0.91524497 1.0 B B20 1 0.50000000 0.79106636 0.26557899 1.0 B B21 1 0.50000000 0.20893364 0.73442101 1.0 B B22 1 0.50000000 0.29106636 0.23442101 1.0 B B23 1 0.50000000 0.70893364 0.76557899 1.0 B B24 1 0.50000000 0.62942993 0.18635238 1.0 B B25 1 0.50000000 0.37057007 0.81364762 1.0 B B26 1 0.50000000 0.12942993 0.31364762 1.0 B B27 1 0.50000000 0.87057007 0.68635238 1.0 B B28 1 0.50000000 0.98435448 0.21305006 1.0 B B29 1 0.50000000 0.01564552 0.78694994 1.0 B B30 1 0.50000000 0.48435448 0.28694994 1.0 B B31 1 0.50000000 0.51564552 0.71305006 1.0 B B32 1 0.50000000 0.59496505 0.02616586 1.0 B B33 1 0.50000000 0.40503495 0.97383414 1.0 B B34 1 0.50000000 0.09496505 0.47383414 1.0 B B35 1 0.50000000 0.90503495 0.52616586 1.0