# generated using pymatgen data_Tm8Ta12Si3Ge13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.87528219 _cell_length_b 7.07452592 _cell_length_c 13.36521655 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.89076126 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm8Ta12Si3Ge13 _chemical_formula_sum 'Tm8 Ta12 Si3 Ge13' _cell_volume 650.07442517 _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 Tm Tm0 1 0.49539853 0.67261305 0.59629772 1.0 Tm Tm1 1 0.99521834 0.82738960 0.90356090 1.0 Tm Tm2 1 0.50486324 0.32794033 0.09519776 1.0 Tm Tm3 1 0.00546447 0.17489797 0.40438441 1.0 Tm Tm4 1 0.50486324 0.32794033 0.40480224 1.0 Tm Tm5 1 0.00546447 0.17489797 0.09561559 1.0 Tm Tm6 1 0.49539853 0.67261305 0.90370228 1.0 Tm Tm7 1 0.99521834 0.82738960 0.59643910 1.0 Ta Ta8 1 0.65769599 0.17517087 0.62801029 1.0 Ta Ta9 1 0.15763796 0.32488894 0.87220992 1.0 Ta Ta10 1 0.34691210 0.82432407 0.12718310 1.0 Ta Ta11 1 0.83729343 0.67143670 0.37314106 1.0 Ta Ta12 1 0.34691210 0.82432407 0.37281690 1.0 Ta Ta13 1 0.83729343 0.67143670 0.12685894 1.0 Ta Ta14 1 0.65769599 0.17517087 0.87198971 1.0 Ta Ta15 1 0.15763796 0.32488894 0.62779008 1.0 Ta Ta16 1 0.83049544 0.48543440 0.75000000 1.0 Ta Ta17 1 0.33066677 0.01471989 0.75000000 1.0 Ta Ta18 1 0.16982174 0.51222435 0.25000000 1.0 Ta Ta19 1 0.66564104 0.98473484 0.25000000 1.0 Si Si20 1 0.45473595 0.37920655 0.75000000 1.0 Si Si21 1 0.95538443 0.12075599 0.75000000 1.0 Si Si22 1 0.54366353 0.61868630 0.25000000 1.0 Ge Ge23 1 0.67840711 0.96431049 0.45986822 1.0 Ge Ge24 1 0.17649856 0.53753921 0.04049955 1.0 Ge Ge25 1 0.32311454 0.03603596 0.95950724 1.0 Ge Ge26 1 0.82301688 0.46359534 0.54093897 1.0 Ge Ge27 1 0.32311454 0.03603596 0.54049276 1.0 Ge Ge28 1 0.82301688 0.46359534 0.95906103 1.0 Ge Ge29 1 0.67840711 0.96431049 0.04013178 1.0 Ge Ge30 1 0.17649856 0.53753921 0.45950045 1.0 Ge Ge31 1 0.04309762 0.88089523 0.25000000 1.0 Ge Ge32 1 0.69583915 0.86361139 0.75000000 1.0 Ge Ge33 1 0.19587920 0.63634033 0.75000000 1.0 Ge Ge34 1 0.30781030 0.14063228 0.25000000 1.0 Ge Ge35 1 0.80391653 0.36247638 0.25000000 1.0