# CIF generated by HEAS from Alexandria entry agm006111371 data_agm006111371 _cell_length_a 9.44297 _cell_length_b 9.44296 _cell_length_c 9.44297 _cell_angle_alpha 68.71804 _cell_angle_beta 68.71804 _cell_angle_gamma 68.71806 _cell_volume 704.69807 _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 Th1 Th 0.00000 0.00000 0.00000 1.00000 Se1 Se 0.22776 0.29226 0.49022 1.00000 Se2 Se 0.70774 0.50978 0.77224 1.00000 Se3 Se 0.50978 0.77224 0.70774 1.00000 Se4 Se 0.77224 0.70774 0.50978 1.00000 Se5 Se 0.29226 0.49022 0.22776 1.00000 Se6 Se 0.49022 0.22776 0.29226 1.00000 Cl1 Cl 0.53432 0.00183 0.70193 1.00000 Cl2 Cl 0.00183 0.70193 0.53432 1.00000 Cl3 Cl 0.70193 0.53432 0.00183 1.00000 Cl4 Cl 0.46568 0.99817 0.29807 1.00000 Cl5 Cl 0.99817 0.29807 0.46568 1.00000 Cl6 Cl 0.29807 0.46568 0.99817 1.00000 Cl7 Cl 0.16231 0.88276 0.74652 1.00000 Cl8 Cl 0.25348 0.83769 0.11724 1.00000 Cl9 Cl 0.11724 0.25348 0.83769 1.00000 Cl10 Cl 0.83769 0.11724 0.25348 1.00000 Cl11 Cl 0.74652 0.16231 0.88276 1.00000 Cl12 Cl 0.88276 0.74652 0.16231 1.00000