# CIF generated by HEAS from Alexandria entry agm006201640 data_agm006201640 _cell_length_a 4.36090 _cell_length_b 4.83730 _cell_length_c 5.87793 _cell_angle_alpha 80.46619 _cell_angle_beta 68.34895 _cell_angle_gamma 45.98249 _cell_volume 82.10964 _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 0.00000 0.00000 0.00000 1.00000 Ir1 Ir 0.95042 0.56417 0.73864 1.00000 Ir2 Ir 0.04958 0.43583 0.26136 1.00000 H1 H 0.50000 0.50000 0.50000 1.00000 H2 H 0.32642 0.56879 0.22030 1.00000 H3 H 0.83107 0.23387 0.36667 1.00000 H4 H 0.16893 0.76613 0.63333 1.00000 H5 H 0.54037 0.95444 0.29611 1.00000 H6 H 0.45963 0.04556 0.70389 1.00000 H7 H 0.67358 0.43121 0.77970 1.00000