# CIF generated by HEAS from Alexandria entry agm003992425 data_agm003992425 _cell_length_a 4.01260 _cell_length_b 6.51551 _cell_length_c 6.72512 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 175.82239 _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 0.00000 0.00000 0.99550 1.00000 Ca2 Ca 0.00000 0.00000 0.50450 1.00000 Ba1 Ba 0.50000 0.50000 0.75000 1.00000 Cl1 Cl 0.50000 0.50000 0.25000 1.00000