# CIF generated by HEAS from Alexandria entry agm054445127 data_agm054445127 _cell_length_a 3.30381 _cell_length_b 4.69192 _cell_length_c 23.41845 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 363.01412 _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 0.50000 0.00000 0.00000 1.00000 Nb1 Nb 0.50000 0.00000 0.19967 1.00000 Nb2 Nb 0.50000 0.00000 0.39966 1.00000 Nb3 Nb 0.50000 0.00000 0.60034 1.00000 Nb4 Nb 0.50000 0.00000 0.80033 1.00000 Nb5 Nb 0.00000 0.50000 0.00000 1.00000 Nb6 Nb 0.00000 0.50000 0.19851 1.00000 Nb7 Nb 0.00000 0.50000 0.39995 1.00000 Nb8 Nb 0.00000 0.50000 0.60005 1.00000 Nb9 Nb 0.00000 0.50000 0.80149 1.00000 Nb10 Nb 0.00000 0.00000 0.09995 1.00000 Nb11 Nb 0.00000 0.00000 0.29943 1.00000 Nb12 Nb 0.00000 0.00000 0.50000 1.00000 Nb13 Nb 0.00000 0.00000 0.70057 1.00000 Nb14 Nb 0.00000 0.00000 0.90005 1.00000 Nb15 Nb 0.50000 0.50000 0.09781 1.00000 Nb16 Nb 0.50000 0.50000 0.29974 1.00000 Nb17 Nb 0.50000 0.50000 0.50000 1.00000 Nb18 Nb 0.50000 0.50000 0.70026 1.00000 Nb19 Nb 0.50000 0.50000 0.90219 1.00000