# generated using pymatgen data_Er3FeB7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.96467168 _cell_length_b 7.96467168 _cell_length_c 9.24431100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 155.36596953 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er3FeB7 _chemical_formula_sum 'Er6 Fe2 B14' _cell_volume 244.43288789 _cell_formula_units_Z 2 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 Er Er0 1 0.89505300 0.10494700 0.44020700 1.0 Er Er1 1 0.10494700 0.89505300 0.55979300 1.0 Er Er2 1 0.89505300 0.10494700 0.05979300 1.0 Er Er3 1 0.10494700 0.89505300 0.94020700 1.0 Er Er4 1 0.24355400 0.75644600 0.25000000 1.0 Er Er5 1 0.75644600 0.24355400 0.75000000 1.0 Fe Fe6 1 0.05374600 0.94625400 0.25000000 1.0 Fe Fe7 1 0.94625400 0.05374600 0.75000000 1.0 B B8 1 0.72747000 0.27253000 0.46678300 1.0 B B9 1 0.27253000 0.72747000 0.53321700 1.0 B B10 1 0.72747000 0.27253000 0.03321700 1.0 B B11 1 0.27253000 0.72747000 0.96678300 1.0 B B12 1 0.63006200 0.36993800 0.15301600 1.0 B B13 1 0.36993800 0.63006200 0.84698400 1.0 B B14 1 0.63006200 0.36993800 0.34698400 1.0 B B15 1 0.36993800 0.63006200 0.65301600 1.0 B B16 1 0.52108800 0.47891200 0.09839000 1.0 B B17 1 0.47891200 0.52108800 0.90161000 1.0 B B18 1 0.52108800 0.47891200 0.40161000 1.0 B B19 1 0.47891200 0.52108800 0.59839000 1.0 B B20 1 0.45813100 0.54186900 0.25000000 1.0 B B21 1 0.54186900 0.45813100 0.75000000 1.0