# CIF generated by HEAS from Alexandria entry agm003368340 data_agm003368340 _cell_length_a 5.88455 _cell_length_b 8.56528 _cell_length_c 6.95256 _cell_angle_alpha 116.98350 _cell_angle_beta 90.00000 _cell_angle_gamma 110.09096 _cell_volume 288.14613 _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 Ti1 Ti 0.02773 0.05545 0.20476 1.00000 Ti2 Ti 0.10948 0.70780 0.86938 1.00000 Ti3 Ti 0.59832 0.70780 0.86938 1.00000 Ti4 Ti 0.10549 0.71027 0.36277 1.00000 Ti5 Ti 0.60478 0.71027 0.36277 1.00000 Ti6 Ti 0.49527 0.99055 0.73502 1.00000 Ti7 Ti 0.50473 0.00945 0.26498 1.00000 Ti8 Ti 0.89451 0.28973 0.63723 1.00000 Ti9 Ti 0.39522 0.28973 0.63723 1.00000 Ti10 Ti 0.89052 0.29220 0.13062 1.00000 Ti11 Ti 0.40168 0.29220 0.13062 1.00000 Ti12 Ti 0.97227 0.94455 0.79524 1.00000 Ir1 Ir 0.25103 0.50206 0.49519 1.00000 Ir2 Ir 0.25401 0.50801 0.00949 1.00000 Ir3 Ir 0.00000 0.00000 0.50000 1.00000 Ir4 Ir 0.74599 0.49199 0.99051 1.00000 Ir5 Ir 0.74897 0.49794 0.50481 1.00000 O1 O 0.71794 1.00000 0.00000 1.00000 O2 O 0.28206 0.00000 1.00000 1.00000