# generated using pymatgen data_Zn6B5Ir11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.87564779 _cell_length_b 8.46358942 _cell_length_c 11.29887253 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zn6B5Ir11 _chemical_formula_sum 'Zn6 B5 Ir11' _cell_volume 274.99537428 _cell_formula_units_Z 1 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 0.34402937 0.50000000 1.0 Zn Zn1 1 0.50000000 0.64201362 0.50000000 1.0 Zn Zn2 1 0.50000000 0.00035580 0.50000000 1.0 Zn Zn3 1 0.50000000 0.51571647 -0.00000000 1.0 Zn Zn4 1 0.50000000 0.98681616 0.20013176 1.0 Zn Zn5 1 0.50000000 0.98681616 0.79986824 1.0 B B6 1 0.50000000 0.31680794 0.26649698 1.0 B B7 1 0.50000000 0.68500690 0.25667911 1.0 B B8 1 0.50000000 0.68500690 0.74332089 1.0 B B9 1 0.50000000 0.31680794 0.73350302 1.0 B B10 1 0.50000000 0.18072911 -0.00000000 1.0 Ir Ir11 1 -0.00000000 0.49987190 0.31857384 1.0 Ir Ir12 1 -0.00000000 0.49987190 0.68142616 1.0 Ir Ir13 1 0.00000000 0.16719691 0.34994670 1.0 Ir Ir14 1 -0.00000000 0.82388709 0.35826878 1.0 Ir Ir15 1 -0.00000000 0.82388709 0.64173122 1.0 Ir Ir16 1 -0.00000000 0.16719691 0.65005330 1.0 Ir Ir17 1 0.00000000 0.29772737 0.12064117 1.0 Ir Ir18 1 0.00000000 0.72651999 0.11945468 1.0 Ir Ir19 1 -0.00000000 0.72651999 0.88054532 1.0 Ir Ir20 1 0.00000000 0.29772737 0.87935883 1.0 Ir Ir21 1 -0.00000000 0.00148709 -0.00000000 1.0