# CIF generated by HEAS from Alexandria entry agm001968462 data_agm001968462 _cell_length_a 4.23166 _cell_length_b 4.23166 _cell_length_c 11.55290 _cell_angle_alpha 79.44713 _cell_angle_beta 79.44713 _cell_angle_gamma 60.00000 _cell_volume 175.10918 _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 P1 P 0.50000 0.50000 0.50000 1.00000 Ca1 Ca 0.12391 0.12391 0.62826 1.00000 Ca2 Ca 0.87609 0.87609 0.37174 1.00000 K1 K 0.00000 0.00000 0.00000 1.00000