# CIF generated by HEAS from Alexandria entry agm005506039 data_agm005506039 _cell_length_a 5.59738 _cell_length_b 5.59738 _cell_length_c 5.59738 _cell_angle_alpha 121.11581 _cell_angle_beta 118.45554 _cell_angle_gamma 90.38696 _cell_volume 124.32044 _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 0.75866 0.25000 0.50866 1.00000 Th2 Th 0.24134 0.75000 0.49134 1.00000 Ti1 Ti 0.50000 0.50000 0.00000 1.00000 Ti2 Ti 0.00000 0.00000 0.00000 1.00000 N1 N 0.19459 0.19459 0.50000 1.00000 N2 N 0.80541 0.80541 0.50000 1.00000 N3 N 0.34858 0.25000 0.09858 1.00000 N4 N 0.80541 0.30541 0.00000 1.00000 N5 N 0.19459 0.69459 0.00000 1.00000 N6 N 0.65142 0.75000 0.90142 1.00000