# generated using pymatgen data_CeYHf3Si4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.29553548 _cell_length_b 7.29553548 _cell_length_c 13.42515574 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeYHf3Si4 _chemical_formula_sum 'Ce4 Y4 Hf12 Si16' _cell_volume 714.55173860 _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 Ce Ce0 1 0.49370310 0.15720797 0.53574260 1.0 Ce Ce1 1 0.50629690 0.84279203 0.03574260 1.0 Ce Ce2 1 0.65720797 0.00629690 0.28574260 1.0 Ce Ce3 1 0.34279203 0.99370310 0.78574260 1.0 Y Y4 1 0.84365701 0.50436114 0.96473512 1.0 Y Y5 1 0.15634299 0.49563886 0.46473512 1.0 Y Y6 1 0.00436114 0.65634299 0.71473512 1.0 Y Y7 1 0.99563886 0.34365701 0.21473512 1.0 Hf Hf8 1 0.67368946 0.32437012 0.74929461 1.0 Hf Hf9 1 0.32631054 0.67562988 0.24929461 1.0 Hf Hf10 1 0.82437012 0.82631054 0.49929461 1.0 Hf Hf11 1 0.17562988 0.17368946 0.99929461 1.0 Hf Hf12 1 0.49536052 0.34955198 0.12421378 1.0 Hf Hf13 1 0.50463948 0.65044802 0.62421378 1.0 Hf Hf14 1 0.84955198 0.00463948 0.87421378 1.0 Hf Hf15 1 0.15044802 0.99536052 0.37421378 1.0 Hf Hf16 1 0.64989739 0.50248700 0.37649177 1.0 Hf Hf17 1 0.35010261 0.49751300 0.87649177 1.0 Hf Hf18 1 0.00248700 0.85010261 0.12649177 1.0 Hf Hf19 1 0.99751300 0.14989739 0.62649177 1.0 Si Si20 1 0.79847148 0.14044661 0.06497417 1.0 Si Si21 1 0.20152852 0.85955339 0.56497417 1.0 Si Si22 1 0.64044661 0.70152852 0.81497417 1.0 Si Si23 1 0.35955339 0.29847148 0.31497417 1.0 Si Si24 1 0.86480214 0.20505878 0.43468006 1.0 Si Si25 1 0.13519786 0.79494122 0.93468006 1.0 Si Si26 1 0.70505878 0.63519786 0.18468006 1.0 Si Si27 1 0.29494122 0.36480214 0.68468006 1.0 Si Si28 1 0.55075202 0.20840780 0.93567689 1.0 Si Si29 1 0.44924798 0.79159220 0.43567689 1.0 Si Si30 1 0.70840780 0.94924798 0.68567689 1.0 Si Si31 1 0.29159220 0.05075202 0.18567689 1.0 Si Si32 1 0.79670134 0.45276187 0.56418998 1.0 Si Si33 1 0.20329866 0.54723813 0.06418998 1.0 Si Si34 1 0.95276187 0.70329866 0.31418998 1.0 Si Si35 1 0.04723813 0.29670134 0.81418998 1.0