# generated using pymatgen data_Zn5B3Ir3Rh4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.84363737 _cell_length_b 11.06778200 _cell_length_c 11.77054609 _cell_angle_alpha 89.71820600 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zn5B3Ir3Rh4 _chemical_formula_sum 'Zn10 B6 Ir6 Rh8' _cell_volume 370.44707381 _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 Zn Zn0 1 0.50000000 0.75252017 0.18751652 1.0 Zn Zn1 1 0.50000000 0.24747983 0.81248348 1.0 Zn Zn2 1 0.50000000 0.44976448 0.13384445 1.0 Zn Zn3 1 0.50000000 0.55023552 0.86615555 1.0 Zn Zn4 1 0.50000000 0.04772542 0.13368588 1.0 Zn Zn5 1 0.50000000 0.95227458 0.86631412 1.0 Zn Zn6 1 0.50000000 0.36780317 0.34474634 1.0 Zn Zn7 1 0.50000000 0.63219683 0.65525366 1.0 Zn Zn8 1 0.50000000 0.13140044 0.34532773 1.0 Zn Zn9 1 0.50000000 0.86859956 0.65467227 1.0 B B10 1 0.50000000 0.75051345 0.96171188 1.0 B B11 1 0.50000000 0.24948655 0.03828812 1.0 B B12 1 0.50000000 0.88293464 0.40706069 1.0 B B13 1 0.50000000 0.11706536 0.59293931 1.0 B B14 1 0.50000000 0.61782662 0.40632970 1.0 B B15 1 0.50000000 0.38217338 0.59367030 1.0 Ir Ir16 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir17 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir18 1 0.00000000 0.75061793 0.47517561 1.0 Ir Ir19 1 0.00000000 0.24938207 0.52482439 1.0 Ir Ir20 1 0.00000000 0.57896845 0.27667748 1.0 Ir Ir21 1 0.00000000 0.42103155 0.72332252 1.0 Rh Rh22 1 0.00000000 0.75205800 0.82041018 1.0 Rh Rh23 1 0.00000000 0.24794200 0.17958982 1.0 Rh Rh24 1 0.00000000 0.87442837 0.03717202 1.0 Rh Rh25 1 0.00000000 0.12557163 0.96282798 1.0 Rh Rh26 1 0.00000000 0.62583791 0.03720530 1.0 Rh Rh27 1 0.00000000 0.37416209 0.96279470 1.0 Rh Rh28 1 0.00000000 0.92285177 0.27875834 1.0 Rh Rh29 1 0.00000000 0.07714823 0.72124166 1.0