# CIF generated by HEAS from Alexandria entry agm005474697 data_agm005474697 _cell_length_a 3.98215 _cell_length_b 3.98215 _cell_length_c 9.30870 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 127.83662 _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 Ca1 Ca 0.33333 0.66667 0.81081 1.00000 Ca2 Ca 0.66667 0.33333 0.31081 1.00000 Cl1 Cl 0.33333 0.66667 0.50464 1.00000 Cl2 Cl 0.66667 0.33333 0.00464 1.00000 O1 O 0.00000 0.00000 0.26755 1.00000 O2 O 0.00000 0.00000 0.76755 1.00000