# CIF generated by HEAS from Alexandria entry agm004875762 data_agm004875762 _cell_length_a 4.15265 _cell_length_b 4.73140 _cell_length_c 6.05305 _cell_angle_alpha 62.18221 _cell_angle_beta 69.93895 _cell_angle_gamma 63.97015 _cell_volume 93.07507 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Zr1 Zr 0.50000 0.50000 0.50000 1.00000 Cu1 Cu 0.00000 0.00000 0.00000 1.00000 H1 H 0.90253 0.56292 0.63203 1.00000 H2 H 0.72754 0.40616 0.13876 1.00000 H3 H 0.09747 0.43708 0.36797 1.00000 H4 H 0.27246 0.59384 0.86124 1.00000 H5 H 0.62357 0.96562 0.31713 1.00000 H6 H 0.37643 0.03438 0.68287 1.00000 H7 H 0.09368 0.96562 0.31713 1.00000 H8 H 0.90632 0.03438 0.68287 1.00000 Ir1 Ir 0.29956 0.25180 0.14908 1.00000 Ir2 Ir 0.70044 0.74820 0.85092 1.00000