# CIF generated by HEAS from Alexandria entry agm005474577 data_agm005474577 _cell_length_a 5.47495 _cell_length_b 5.47495 _cell_length_c 5.01324 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 130.13958 _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 0.68697 0.00000 0.00000 1.00000 Zr2 Zr 0.31303 0.31303 0.00000 1.00000 Zr3 Zr 0.00000 0.68697 0.00000 1.00000 Zr4 Zr 0.66667 0.33333 0.50000 1.00000 Zr5 Zr 0.33333 0.66667 0.50000 1.00000 As1 As 0.00000 0.00000 0.50000 1.00000