# CIF generated by HEAS from Alexandria entry agm005677783 data_agm005677783 _cell_length_a 10.94934 _cell_length_b 11.72194 _cell_length_c 8.96119 _cell_angle_alpha 90.00000 _cell_angle_beta 125.32104 _cell_angle_gamma 90.00000 _cell_volume 938.43339 _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 0.25538 0.04080 0.04787 1.00000 Ba2 Ba 0.24462 0.54080 0.45213 1.00000 Ba3 Ba 0.74462 0.95920 0.95213 1.00000 Ba4 Ba 0.75538 0.45920 0.54787 1.00000 Ba5 Ba 0.38076 0.62919 0.14902 1.00000 Ba6 Ba 0.11924 0.12919 0.35098 1.00000 Ba7 Ba 0.61924 0.37081 0.85098 1.00000 Ba8 Ba 0.88076 0.87081 0.64902 1.00000 Ba9 Ba 0.82672 0.66370 0.17835 1.00000 Ba10 Ba 0.67328 0.16370 0.32165 1.00000 Ba11 Ba 0.17328 0.33630 0.82165 1.00000 Ba12 Ba 0.32672 0.83630 0.67835 1.00000 Al1 Al 0.48986 0.88669 0.43667 1.00000 Al2 Al 0.01014 0.38669 0.06333 1.00000 Al3 Al 0.51014 0.11331 0.56332 1.00000 Al4 Al 0.98986 0.61331 0.93668 1.00000 Tl1 Tl 0.58125 0.87287 0.17677 1.00000 Tl2 Tl 0.91875 0.37287 0.32323 1.00000 Tl3 Tl 0.41875 0.12713 0.82323 1.00000 Tl4 Tl 0.08125 0.62713 0.67677 1.00000 Tl5 Tl 0.12482 0.81735 0.18506 1.00000 Tl6 Tl 0.37518 0.31735 0.31494 1.00000 Tl7 Tl 0.87518 0.18265 0.81494 1.00000 Tl8 Tl 0.62482 0.68265 0.68506 1.00000