# CIF generated by HEAS from Alexandria entry agm004875893 data_agm004875893 _cell_length_a 4.34046 _cell_length_b 4.61572 _cell_length_c 6.49686 _cell_angle_alpha 67.32770 _cell_angle_beta 70.48563 _cell_angle_gamma 61.95388 _cell_volume 104.11576 _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 Zn1 Zn 0.00000 0.00000 0.00000 1.00000 H1 H 0.92466 0.46814 0.68254 1.00000 H2 H 0.70005 0.47125 0.12866 1.00000 H3 H 0.07534 0.53186 0.31746 1.00000 H4 H 0.29996 0.52875 0.87134 1.00000 H5 H 0.58397 0.03482 0.31669 1.00000 H6 H 0.41603 0.96518 0.68331 1.00000 H7 H 0.06452 0.03482 0.31669 1.00000 H8 H 0.93548 0.96518 0.68331 1.00000 Ir1 Ir 0.29732 0.26897 0.13639 1.00000 Ir2 Ir 0.70268 0.73103 0.86361 1.00000