# CIF generated by HEAS from Alexandria entry agm040339587 data_agm040339587 _cell_length_a 9.98611 _cell_length_b 9.98611 _cell_length_c 9.16404 _cell_angle_alpha 74.65570 _cell_angle_beta 74.65570 _cell_angle_gamma 24.79381 _cell_volume 368.89657 _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 Pa1 Pa 0.50000 0.50000 0.50000 1.00000 Tl1 Tl 0.50000 0.50000 0.00000 1.00000 Tl2 Tl 0.82546 0.82546 0.34509 1.00000 Tl3 Tl 0.17454 0.17454 0.65491 1.00000 Sn1 Sn 0.82777 0.82777 0.85549 1.00000 Sn2 Sn 0.17223 0.17223 0.14451 1.00000 Se1 Se 0.35583 0.35583 0.59583 1.00000 Se2 Se 0.67426 0.67426 0.92466 1.00000 Se3 Se 0.64417 0.64417 0.40417 1.00000 Se4 Se 0.00028 0.00028 0.29279 1.00000 Se5 Se 0.99972 0.99972 0.70721 1.00000 Se6 Se 0.32574 0.32574 0.07534 1.00000