# generated using pymatgen data_Tm2Hf2ZrSi4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.24228640 _cell_length_b 7.24228640 _cell_length_c 13.26034553 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2Hf2ZrSi4 _chemical_formula_sum 'Tm8 Hf8 Zr4 Si16' _cell_volume 695.51456788 _cell_formula_units_Z 4 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 0.99634266 0.34452686 0.21460582 1.0 Tm Tm1 1 0.00365734 0.65547314 0.71460582 1.0 Tm Tm2 1 0.15547314 0.49634266 0.46460582 1.0 Tm Tm3 1 0.50365734 0.84452686 0.03539418 1.0 Tm Tm4 1 0.84452686 0.50365734 0.96460582 1.0 Tm Tm5 1 0.49634266 0.15547314 0.53539418 1.0 Tm Tm6 1 0.34452686 0.99634266 0.78539418 1.0 Tm Tm7 1 0.65547314 0.00365734 0.28539418 1.0 Hf Hf8 1 0.14678137 0.99640479 0.37475722 1.0 Hf Hf9 1 0.85321863 0.00359521 0.87475722 1.0 Hf Hf10 1 0.50359521 0.64678137 0.62475722 1.0 Hf Hf11 1 0.35321863 0.49640479 0.87524278 1.0 Hf Hf12 1 0.49640479 0.35321863 0.12475722 1.0 Hf Hf13 1 0.64678137 0.50359521 0.37524278 1.0 Hf Hf14 1 0.99640479 0.14678137 0.62524278 1.0 Hf Hf15 1 0.00359521 0.85321863 0.12524278 1.0 Zr Zr16 1 0.17534971 0.17534971 0.00000000 1.0 Zr Zr17 1 0.82465029 0.82465029 0.50000000 1.0 Zr Zr18 1 0.32465029 0.67534971 0.25000000 1.0 Zr Zr19 1 0.67534971 0.32465029 0.75000000 1.0 Si Si20 1 0.35947810 0.29396361 0.31810685 1.0 Si Si21 1 0.64052190 0.70603639 0.81810685 1.0 Si Si22 1 0.20603639 0.85947810 0.56810685 1.0 Si Si23 1 0.14052190 0.79396361 0.93189315 1.0 Si Si24 1 0.79396361 0.14052190 0.06810685 1.0 Si Si25 1 0.85947810 0.20603639 0.43189315 1.0 Si Si26 1 0.29396361 0.35947810 0.68189315 1.0 Si Si27 1 0.70603639 0.64052190 0.18189315 1.0 Si Si28 1 0.29764574 0.04961917 0.18726702 1.0 Si Si29 1 0.70235426 0.95038083 0.68726702 1.0 Si Si30 1 0.45038083 0.79764574 0.43726702 1.0 Si Si31 1 0.20235426 0.54961917 0.06273298 1.0 Si Si32 1 0.54961917 0.20235426 0.93726702 1.0 Si Si33 1 0.79764574 0.45038083 0.56273298 1.0 Si Si34 1 0.04961917 0.29764574 0.81273298 1.0 Si Si35 1 0.95038083 0.70235426 0.31273298 1.0