# CIF generated by HEAS from Alexandria entry agm002164366 data_agm002164366 _cell_length_a 3.39547 _cell_length_b 3.39547 _cell_length_c 9.99400 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 115.22317 _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 0.75000 0.75000 0.81627 1.00000 Ca2 Ca 0.25000 0.25000 0.18373 1.00000 N1 N 0.75000 0.25000 0.00000 1.00000 N2 N 0.25000 0.75000 0.00000 1.00000 Cl1 Cl 0.25000 0.25000 0.67691 1.00000 Cl2 Cl 0.75000 0.75000 0.32309 1.00000