# CIF generated by HEAS from Alexandria entry agm005773772 data_agm005773772 _cell_length_a 4.49110 _cell_length_b 5.31810 _cell_length_c 5.51053 _cell_angle_alpha 61.55296 _cell_angle_beta 65.95204 _cell_angle_gamma 65.02354 _cell_volume 101.32333 _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 Zr1 Zr 0.00000 0.50000 0.50000 1.00000 Ti1 Ti 0.64321 0.00854 0.70504 1.00000 Ti2 Ti 0.35679 0.99146 0.29496 1.00000 Ti3 Ti 0.71409 0.43025 0.14158 1.00000 Ti4 Ti 0.28591 0.56975 0.85842 1.00000 Mn1 Mn 0.00000 0.00000 0.00000 1.00000