# CIF generated by HEAS from Alexandria entry agm003190885 data_agm003190885 _cell_length_a 5.71770 _cell_length_b 6.09628 _cell_length_c 3.27006 _cell_angle_alpha 74.44274 _cell_angle_beta 90.00000 _cell_angle_gamma 117.96611 _cell_volume 95.91937 _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 Sc1 Sc 0.99833 0.99782 0.00109 1.00000 Sc2 Sc 0.08024 0.50000 0.25000 1.00000 Sc3 Sc 0.50050 0.00218 0.49891 1.00000 Zr1 Zr 0.58760 0.50000 0.75000 1.00000