# generated using pymatgen data_U12Ge3Te20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.25682456 _cell_length_b 8.92996275 _cell_length_c 26.28070116 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural U12Ge3Te20 _chemical_formula_sum 'U12 Ge3 Te20' _cell_volume 999.01577673 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy U U0 1 0.25000000 0.27738393 0.12498558 1.0 U U1 1 0.25000000 0.27738393 0.62501442 1.0 U U2 1 0.75000000 0.72180995 0.37500000 1.0 U U3 1 0.75000000 0.72287531 0.87500000 1.0 U U4 1 0.25000000 0.25620865 0.46017458 1.0 U U5 1 0.25000000 0.25906279 0.95766456 1.0 U U6 1 0.25000000 0.25620865 0.28982542 1.0 U U7 1 0.25000000 0.25906279 0.79233544 1.0 U U8 1 0.75000000 0.74143317 0.04257861 1.0 U U9 1 0.75000000 0.74395170 0.54171733 1.0 U U10 1 0.75000000 0.74395170 0.20828267 1.0 U U11 1 0.75000000 0.74143317 0.70742139 1.0 Ge Ge12 1 0.25000000 0.99255844 0.87500000 1.0 Ge Ge13 1 0.75000000 0.00783029 0.12527156 1.0 Ge Ge14 1 0.75000000 0.00783029 0.62472844 1.0 Te Te15 1 0.25000000 0.00635405 0.20099496 1.0 Te Te16 1 0.25000000 0.00695281 0.70088339 1.0 Te Te17 1 0.25000000 0.00695281 0.04911661 1.0 Te Te18 1 0.25000000 0.00635405 0.54900504 1.0 Te Te19 1 0.75000000 0.99434297 0.30395055 1.0 Te Te20 1 0.75000000 0.99308582 0.79909555 1.0 Te Te21 1 0.75000000 0.99434297 0.44604945 1.0 Te Te22 1 0.75000000 0.99308582 0.95090445 1.0 Te Te23 1 0.25000000 0.62938580 0.45873828 1.0 Te Te24 1 0.25000000 0.62880585 0.95939198 1.0 Te Te25 1 0.25000000 0.62938580 0.29126172 1.0 Te Te26 1 0.25000000 0.62880585 0.79060802 1.0 Te Te27 1 0.75000000 0.37112729 0.04076595 1.0 Te Te28 1 0.75000000 0.37201303 0.54102900 1.0 Te Te29 1 0.75000000 0.37201303 0.20897100 1.0 Te Te30 1 0.75000000 0.37112729 0.70923405 1.0 Te Te31 1 0.25000000 0.64004612 0.12528961 1.0 Te Te32 1 0.25000000 0.64004612 0.62471039 1.0 Te Te33 1 0.75000000 0.35589309 0.37500000 1.0 Te Te34 1 0.75000000 0.35969464 0.87500000 1.0