# CIF generated by HEAS from Alexandria entry agm005407799 data_agm005407799 _cell_length_a 12.60151 _cell_length_b 12.60151 _cell_length_c 12.60151 _cell_angle_alpha 16.03141 _cell_angle_beta 16.03141 _cell_angle_gamma 16.03141 _cell_volume 133.03222 _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 0.00000 1.00000 Ca2 Ca 0.78743 0.78743 0.78743 1.00000 Ca3 Ca 0.21257 0.21257 0.21257 1.00000 Fe1 Fe 0.39516 0.39516 0.39516 1.00000 Fe2 Fe 0.60484 0.60484 0.60484 1.00000