# CIF generated by HEAS from Alexandria entry agm018626537 data_agm018626537 _cell_length_a 10.31404 _cell_length_b 10.31404 _cell_length_c 20.16551 _cell_angle_alpha 75.38689 _cell_angle_beta 104.61311 _cell_angle_gamma 119.91732 _cell_volume 1778.62320 _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 Cs1 Cs 0.25139 0.56413 0.75001 1.00000 Cs2 Cs 0.56413 0.25139 0.74999 1.00000 Cs3 Cs 0.93586 0.93586 0.75000 1.00000 Cs4 Cs 0.06414 0.06414 0.25000 1.00000 Cs5 Cs 0.74861 0.43587 0.24999 1.00000 Cs6 Cs 0.43587 0.74861 0.25001 1.00000 Cs7 Cs 0.66015 0.83976 0.97964 1.00000 Cs8 Cs 0.16024 0.33985 0.47964 1.00000 Cs9 Cs 0.33985 0.16024 0.02036 1.00000 Cs10 Cs 0.83976 0.66015 0.52036 1.00000 Ti1 Ti 0.16912 0.68805 0.92754 1.00000 Ti2 Ti 0.94561 0.33104 0.92704 1.00000 Ti3 Ti 0.81336 0.55382 0.92753 1.00000 Ti4 Ti 0.44618 0.18664 0.42753 1.00000 Ti5 Ti 0.66896 0.05439 0.42704 1.00000 Ti6 Ti 0.31195 0.83088 0.42754 1.00000 Ti7 Ti 0.83088 0.31195 0.07246 1.00000 Ti8 Ti 0.05439 0.66896 0.07296 1.00000 Ti9 Ti 0.18664 0.44618 0.07247 1.00000 Ti10 Ti 0.55382 0.81336 0.57247 1.00000 Ti11 Ti 0.33104 0.94561 0.57296 1.00000 Ti12 Ti 0.68805 0.16912 0.57246 1.00000 Se1 Se 0.31524 0.73513 0.05044 1.00000 Se2 Se 0.97085 0.18499 0.04980 1.00000 Se3 Se 0.76525 0.52949 0.05065 1.00000 Se4 Se 0.47051 0.23475 0.55065 1.00000 Se5 Se 0.81501 0.02915 0.54980 1.00000 Se6 Se 0.26487 0.68476 0.55044 1.00000 Se7 Se 0.68476 0.26487 0.94956 1.00000 Se8 Se 0.02915 0.81501 0.95020 1.00000 Se9 Se 0.23475 0.47051 0.94935 1.00000 Se10 Se 0.52949 0.76525 0.44935 1.00000 Se11 Se 0.18499 0.97085 0.45020 1.00000 Se12 Se 0.73513 0.31524 0.44956 1.00000 Se13 Se 0.94686 0.55476 0.83672 1.00000 Se14 Se 0.44524 0.05314 0.33672 1.00000 Se15 Se 0.05314 0.44524 0.16328 1.00000 Se16 Se 0.55476 0.94686 0.66328 1.00000 Cl1 Cl 0.34494 0.86899 0.85721 1.00000 Cl2 Cl 0.87865 0.15511 0.85615 1.00000 Cl3 Cl 0.63285 0.61920 0.85677 1.00000 Cl4 Cl 0.38080 0.36715 0.35677 1.00000 Cl5 Cl 0.84489 0.12135 0.35615 1.00000 Cl6 Cl 0.13101 0.65506 0.35721 1.00000 Cl7 Cl 0.65506 0.13101 0.14279 1.00000 Cl8 Cl 0.12135 0.84489 0.14385 1.00000 Cl9 Cl 0.36715 0.38080 0.14323 1.00000 Cl10 Cl 0.61920 0.63285 0.64323 1.00000 Cl11 Cl 0.15511 0.87865 0.64385 1.00000 Cl12 Cl 0.86899 0.34494 0.64279 1.00000 Cl13 Cl 0.24926 0.24926 0.75000 1.00000 Cl14 Cl 0.75074 0.75074 0.25000 1.00000