# CIF generated by HEAS from Alexandria entry agm004875978 data_agm004875978 _cell_length_a 4.70344 _cell_length_b 4.70344 _cell_length_c 6.27053 _cell_angle_alpha 67.97299 _cell_angle_beta 67.97299 _cell_angle_gamma 60.00000 _cell_volume 108.28455 _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 Th1 Th 0.50000 0.50000 0.50000 1.00000 H1 H 0.17524 0.17524 0.47428 1.00000 H2 H 0.64255 0.28156 0.16590 1.00000 H3 H 0.82476 0.82476 0.52572 1.00000 H4 H 0.91000 0.64255 0.16590 1.00000 H5 H 0.09000 0.35745 0.83410 1.00000 H6 H 0.28156 0.91000 0.16590 1.00000 H7 H 0.71844 0.09000 0.83410 1.00000 H8 H 0.35745 0.71844 0.83410 1.00000 Ir1 Ir 0.27109 0.27109 0.18672 1.00000 Ir2 Ir 0.72891 0.72891 0.81328 1.00000 Rh1 Rh 0.00000 0.00000 0.00000 1.00000