# generated using pymatgen data_SmErReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.69479320 _cell_length_b 9.18323518 _cell_length_c 11.60822711 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmErReB6 _chemical_formula_sum 'Sm4 Er4 Re4 B24' _cell_volume 393.86894405 _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 Sm Sm0 1 0.00000000 0.32325391 0.41435224 1.0 Sm Sm1 1 0.00000000 0.67674609 0.58564776 1.0 Sm Sm2 1 0.00000000 0.82325391 0.08564776 1.0 Sm Sm3 1 0.00000000 0.17674609 0.91435224 1.0 Er Er4 1 0.00000000 0.94254786 0.36877022 1.0 Er Er5 1 0.00000000 0.05745214 0.63122978 1.0 Er Er6 1 0.00000000 0.44254786 0.13122978 1.0 Er Er7 1 0.00000000 0.55745214 0.86877022 1.0 Re Re8 1 0.00000000 0.63933201 0.31924317 1.0 Re Re9 1 0.00000000 0.36066799 0.68075683 1.0 Re Re10 1 0.00000000 0.13933201 0.18075683 1.0 Re Re11 1 0.00000000 0.86066799 0.81924317 1.0 B B12 1 0.50000000 0.55471949 0.43110729 1.0 B B13 1 0.50000000 0.44528051 0.56889271 1.0 B B14 1 0.50000000 0.05471949 0.06889271 1.0 B B15 1 0.50000000 0.94528051 0.93110729 1.0 B B16 1 0.50000000 0.75029059 0.41644352 1.0 B B17 1 0.50000000 0.24970941 0.58355648 1.0 B B18 1 0.50000000 0.25029059 0.08355648 1.0 B B19 1 0.50000000 0.74970941 0.91644352 1.0 B B20 1 0.50000000 0.79149806 0.26535011 1.0 B B21 1 0.50000000 0.20850194 0.73464989 1.0 B B22 1 0.50000000 0.29149806 0.23464989 1.0 B B23 1 0.50000000 0.70850194 0.76535011 1.0 B B24 1 0.50000000 0.62952579 0.18570423 1.0 B B25 1 0.50000000 0.37047421 0.81429577 1.0 B B26 1 0.50000000 0.12952579 0.31429577 1.0 B B27 1 0.50000000 0.87047421 0.68570423 1.0 B B28 1 0.50000000 0.98342501 0.21276876 1.0 B B29 1 0.50000000 0.01657499 0.78723124 1.0 B B30 1 0.50000000 0.48342501 0.28723124 1.0 B B31 1 0.50000000 0.51657499 0.71276876 1.0 B B32 1 0.50000000 0.59607844 0.02653360 1.0 B B33 1 0.50000000 0.40392156 0.97346640 1.0 B B34 1 0.50000000 0.09607844 0.47346640 1.0 B B35 1 0.50000000 0.90392156 0.52653360 1.0