# CIF generated by HEAS from Alexandria entry agm005698280 data_agm005698280 _cell_length_a 8.02911 _cell_length_b 8.02911 _cell_length_c 5.67415 _cell_angle_alpha 44.96679 _cell_angle_beta 44.96678 _cell_angle_gamma 60.00000 _cell_volume 182.68459 _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 0.25035 0.25035 0.24895 1.00000 Zr2 Zr 0.74965 0.74965 0.75105 1.00000 Sc1 Sc 0.24996 0.75008 0.75001 1.00000 Sc2 Sc 0.75008 0.24996 0.75001 1.00000 Sc3 Sc 0.24996 0.24996 0.75001 1.00000 Sc4 Sc 0.24992 0.75004 0.24999 1.00000 Sc5 Sc 0.75004 0.24992 0.24999 1.00000 Sc6 Sc 0.75004 0.75004 0.24999 1.00000 C1 C 0.00000 0.00000 0.00000 1.00000 C2 C 0.50000 0.00000 0.00000 1.00000 C3 C 0.50000 0.50000 0.00000 1.00000 C4 C 0.00000 0.50000 0.00000 1.00000