# CIF generated by HEAS from Alexandria entry agm004635648 data_agm004635648 _cell_length_a 7.70003 _cell_length_b 7.70003 _cell_length_c 8.38094 _cell_angle_alpha 98.77046 _cell_angle_beta 98.77046 _cell_angle_gamma 119.94792 _cell_volume 410.08597 _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 0.93343 0.61045 0.79808 1.00000 Tl2 Tl 0.74611 0.74611 0.20526 1.00000 Tl3 Tl 0.06657 0.38955 0.20192 1.00000 Tl4 Tl 0.61045 0.93343 0.79808 1.00000 Tl5 Tl 0.25389 0.25389 0.79474 1.00000 Tl6 Tl 0.38955 0.06657 0.20192 1.00000 Hg1 Hg 0.17360 0.82640 0.50000 1.00000 Hg2 Hg 0.82640 0.17360 0.50000 1.00000 Hg3 Hg 0.50000 0.50000 0.50000 1.00000 Se1 Se 0.33450 0.66550 0.00000 1.00000 Se2 Se 0.66550 0.33450 0.00000 1.00000 S1 S 0.00000 0.00000 0.00000 1.00000