# CIF generated by HEAS from Alexandria entry agm073023398 data_agm073023398 _cell_length_a 13.33040 _cell_length_b 13.33040 _cell_length_c 13.33040 _cell_angle_alpha 109.47122 _cell_angle_beta 109.47122 _cell_angle_gamma 109.47122 _cell_volume 1823.50600 _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 Ba1 Ba 0.89888 0.92460 0.72940 1.00000 Ba2 Ba 0.25000 0.12500 0.87500 1.00000 Ba3 Ba 0.57540 0.47429 0.80480 1.00000 Ba4 Ba 0.47429 0.80480 0.57540 1.00000 Ba5 Ba 0.16948 0.77060 0.69520 1.00000 Ba6 Ba 0.52571 0.83052 0.10112 1.00000 Ba7 Ba 0.60112 0.33052 0.02571 1.00000 Ba8 Ba 0.30480 0.97429 0.07540 1.00000 Ba9 Ba 0.83052 0.10112 0.52571 1.00000 Ba10 Ba 0.33052 0.02571 0.60112 1.00000 Ba11 Ba 0.72940 0.89888 0.92460 1.00000 Ba12 Ba 0.39888 0.22940 0.42460 1.00000 Ba13 Ba 0.12500 0.87500 0.25000 1.00000 Ba14 Ba 0.92460 0.72940 0.89888 1.00000 Ba15 Ba 0.37500 0.62500 0.75000 1.00000 Ba16 Ba 0.19520 0.27060 0.66948 1.00000 Ba17 Ba 0.27060 0.66948 0.19520 1.00000 Ba18 Ba 0.66948 0.19520 0.27060 1.00000 Ba19 Ba 0.42460 0.39888 0.22940 1.00000 Ba20 Ba 0.87500 0.25000 0.12500 1.00000 Ba21 Ba 0.77060 0.69520 0.16948 1.00000 Ba22 Ba 0.69520 0.16948 0.77060 1.00000 Ba23 Ba 0.07540 0.30480 0.97429 1.00000 Ba24 Ba 0.02571 0.60112 0.33052 1.00000 Ba25 Ba 0.22940 0.42460 0.39888 1.00000 Ba26 Ba 0.80480 0.57540 0.47429 1.00000 Ba27 Ba 0.10112 0.52571 0.83052 1.00000 Ba28 Ba 0.75000 0.37500 0.62500 1.00000 Ba29 Ba 0.97429 0.07540 0.30480 1.00000 Ba30 Ba 0.62500 0.75000 0.37500 1.00000 Pb1 Pb 0.60262 0.60262 0.60262 1.00000 Pb2 Pb 0.89738 0.50000 0.00000 1.00000 Pb3 Pb 0.10262 0.10262 0.10262 1.00000 Pb4 Pb 0.00000 0.39738 0.50000 1.00000 Pb5 Pb 0.00000 0.89738 0.50000 1.00000 Pb6 Pb 0.39738 0.50000 0.00000 1.00000 Pb7 Pb 0.50000 0.00000 0.39738 1.00000 Pb8 Pb 0.50000 0.00000 0.89738 1.00000