# CIF generated by HEAS from Alexandria entry agm005654865 data_agm005654865 _cell_length_a 4.83504 _cell_length_b 13.13134 _cell_length_c 13.49391 _cell_angle_alpha 90.00000 _cell_angle_beta 89.92907 _cell_angle_gamma 90.00000 _cell_volume 856.73427 _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 Tl1 Tl 0.50513 0.34962 0.56446 1.00000 Tl2 Tl 0.49487 0.65038 0.43554 1.00000 Tl3 Tl 0.49487 0.84962 0.93554 1.00000 Tl4 Tl 0.50513 0.15038 0.06446 1.00000 Tl5 Tl 0.50509 0.40805 0.23922 1.00000 Tl6 Tl 0.49491 0.59195 0.76078 1.00000 Tl7 Tl 0.49491 0.90805 0.26078 1.00000 Tl8 Tl 0.50509 0.09195 0.73922 1.00000 Tl9 Tl 0.50000 0.50000 0.00000 1.00000 Tl10 Tl 0.50000 0.00000 0.50000 1.00000 As1 As 0.00443 0.22511 0.38184 1.00000 As2 As 0.99557 0.77489 0.61816 1.00000 As3 As 0.99557 0.72511 0.11816 1.00000 As4 As 0.00443 0.27489 0.88184 1.00000 Se1 Se 0.00278 0.17693 0.55408 1.00000 Se2 Se 0.99722 0.82307 0.44592 1.00000 Se3 Se 0.99722 0.67693 0.94592 1.00000 Se4 Se 0.00278 0.32307 0.05408 1.00000 Se5 Se 0.50489 0.18326 0.32332 1.00000 Se6 Se 0.49511 0.81674 0.67668 1.00000 Se7 Se 0.49511 0.68326 0.17668 1.00000 Se8 Se 0.50489 0.31674 0.82332 1.00000 Se9 Se 0.00453 0.40806 0.39184 1.00000 Se10 Se 0.99547 0.59194 0.60816 1.00000 Se11 Se 0.99547 0.90806 0.10816 1.00000 Se12 Se 0.00453 0.09194 0.89184 1.00000