# CIF generated by HEAS from Alexandria entry agm002394863 data_agm002394863 _cell_length_a 5.83032 _cell_length_b 5.83032 _cell_length_c 5.83032 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 198.18792 _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 0.00000 0.00000 0.00000 1.00000 Ca1 Ca 0.00000 0.50000 0.00000 1.00000 Ca2 Ca 0.00000 0.00000 0.50000 1.00000 Ca3 Ca 0.50000 0.00000 0.00000 1.00000 Al1 Al 0.50000 0.50000 0.50000 1.00000