# CIF generated by HEAS from Alexandria entry agm005608409 data_agm005608409 _cell_length_a 9.97166 _cell_length_b 10.24934 _cell_length_c 10.24934 _cell_angle_alpha 118.28078 _cell_angle_beta 102.30295 _cell_angle_gamma 102.30296 _cell_volume 839.11559 _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 Zr1 Zr 0.36183 0.13421 0.13421 1.00000 Zr2 Zr 0.63817 0.86579 0.86579 1.00000 Zr3 Zr 0.65138 0.04760 0.23602 1.00000 Zr4 Zr 0.34862 0.76398 0.95240 1.00000 Zr5 Zr 0.34862 0.95240 0.76398 1.00000 Zr6 Zr 0.65138 0.23602 0.04760 1.00000 Tl1 Tl 0.17159 0.55161 0.22849 1.00000 Tl2 Tl 0.82841 0.77151 0.44839 1.00000 Tl3 Tl 0.82841 0.44839 0.77151 1.00000 Tl4 Tl 0.17159 0.22849 0.55161 1.00000 Cl1 Cl 0.50000 0.20718 0.79282 1.00000 Cl2 Cl 0.16911 0.49501 0.89187 1.00000 Cl3 Cl 0.16911 0.89187 0.49501 1.00000 Cl4 Cl 0.83089 0.50499 0.10813 1.00000 Cl5 Cl 0.78948 0.71664 0.71664 1.00000 Cl6 Cl 0.21052 0.28336 0.28336 1.00000 Cl7 Cl 0.51795 0.40732 0.20023 1.00000 Cl8 Cl 0.48205 0.79977 0.59268 1.00000 Cl9 Cl 0.48205 0.59268 0.79977 1.00000 Cl10 Cl 0.51795 0.20023 0.40732 1.00000 Cl11 Cl 0.16837 0.68492 0.68492 1.00000 Cl12 Cl 0.81725 0.90941 0.11482 1.00000 Cl13 Cl 0.81725 0.11482 0.90941 1.00000 Cl14 Cl 0.18275 0.09059 0.88518 1.00000 Cl15 Cl 0.18275 0.88518 0.09059 1.00000 Cl16 Cl 0.50000 0.79282 0.20718 1.00000 Cl17 Cl 0.83163 0.31508 0.31508 1.00000 Cl18 Cl 0.83089 0.10813 0.50499 1.00000