# CIF generated by HEAS from Alexandria entry agm004242560 data_agm004242560 _cell_length_a 7.17976 _cell_length_b 7.17976 _cell_length_c 7.17976 _cell_angle_alpha 148.83206 _cell_angle_beta 131.43000 _cell_angle_gamma 58.84482 _cell_volume 142.47530 _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 0.00039 0.00039 1.00000 1.00000 Ca2 Ca 0.68278 0.18278 0.50000 1.00000 Ba1 Ba 0.31086 0.81086 0.50000 1.00000 Fe1 Fe 0.50597 0.50597 0.00000 1.00000