# CIF generated by HEAS from Alexandria entry agm079087345 data_agm079087345 _cell_length_a 4.47931 _cell_length_b 4.46701 _cell_length_c 4.44455 _cell_angle_alpha 89.99630 _cell_angle_beta 90.00462 _cell_angle_gamma 120.09581 _cell_volume 76.94236 _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 0.28410 0.66665 0.50007 1.00000 Cu1 Cu 0.99791 0.99318 0.00037 1.00000 Cu2 Cu 0.67129 0.34017 0.99993 1.00000 H1 H 0.78389 0.66683 0.72731 1.00000 H2 H 0.36014 0.93706 0.99989 1.00000 H3 H 0.08953 0.39613 0.00004 1.00000 H4 H 0.25780 0.15278 0.49910 1.00000 H5 H 0.77155 0.18059 0.50032 1.00000 H6 H 0.78380 0.66661 0.27295 1.00000