# CIF generated by HEAS from Alexandria entry agm005959622 data_agm005959622 _cell_length_a 8.01770 _cell_length_b 8.01770 _cell_length_c 9.26110 _cell_angle_alpha 64.24959 _cell_angle_beta 64.24960 _cell_angle_gamma 83.17119 _cell_volume 481.17393 _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 0.94400 0.94400 0.05181 1.00000 Tl1 Tl 0.80055 0.22267 0.49097 1.00000 Tl2 Tl 0.51471 0.51471 0.88549 1.00000 Tl3 Tl 0.22267 0.80055 0.49097 1.00000 I1 I 0.14656 0.14656 0.12883 1.00000 I2 I 0.62551 0.14405 0.20837 1.00000 I3 I 0.96756 0.31477 0.74117 1.00000 I4 I 0.14405 0.62551 0.20837 1.00000 I5 I 0.64822 0.64822 0.40645 1.00000 I6 I 0.31477 0.96756 0.74117 1.00000 I7 I 0.79641 0.79641 0.89638 1.00000