# generated using pymatgen data_Lu3CrB7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.88376217 _cell_length_b 7.88376159 _cell_length_c 9.18520055 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 155.30090361 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu3CrB7 _chemical_formula_sum 'Lu6 Cr2 B14' _cell_volume 238.54971387 _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 Lu Lu0 1 0.75747444 0.24252556 0.25000000 1.0 Lu Lu1 1 0.24252556 0.75747444 0.75000000 1.0 Lu Lu2 1 0.89443694 0.10556306 0.55826007 1.0 Lu Lu3 1 0.10556306 0.89443694 0.44173993 1.0 Lu Lu4 1 0.10556306 0.89443694 0.05826007 1.0 Lu Lu5 1 0.89443694 0.10556306 0.94173993 1.0 Cr Cr6 1 0.94749102 0.05250898 0.25000000 1.0 Cr Cr7 1 0.05250898 0.94749102 0.75000000 1.0 B B8 1 0.54616213 0.45383787 0.25000000 1.0 B B9 1 0.45383787 0.54616213 0.75000000 1.0 B B10 1 0.51953375 0.48046625 0.90434988 1.0 B B11 1 0.48046625 0.51953375 0.09565012 1.0 B B12 1 0.48046625 0.51953375 0.40434988 1.0 B B13 1 0.51953375 0.48046625 0.59565012 1.0 B B14 1 0.63136885 0.36863115 0.84906709 1.0 B B15 1 0.36863115 0.63136885 0.15093291 1.0 B B16 1 0.72732872 0.27267128 0.96706477 1.0 B B17 1 0.27267128 0.72732872 0.03293523 1.0 B B18 1 0.27267128 0.72732872 0.46706477 1.0 B B19 1 0.72732872 0.27267128 0.53293523 1.0 B B20 1 0.63136885 0.36863115 0.65093291 1.0 B B21 1 0.36863115 0.63136885 0.34906709 1.0