# generated using pymatgen data_Tb3Ce(Hf3Si4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.28111140 _cell_length_b 7.28535133 _cell_length_c 13.39535383 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.01148637 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3Ce(Hf3Si4)2 _chemical_formula_sum 'Tb6 Ce2 Hf12 Si16' _cell_volume 710.56261900 _cell_formula_units_Z 2 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 Tb Tb0 1 0.15659936 0.49593398 0.46547382 1.0 Tb Tb1 1 0.50407741 0.84381756 0.03483773 1.0 Tb Tb2 1 0.84340064 0.50406602 0.96547382 1.0 Tb Tb3 1 0.49592259 0.15618244 0.53483773 1.0 Tb Tb4 1 0.34266765 0.99416161 0.78560896 1.0 Tb Tb5 1 0.65733235 0.00583839 0.28560896 1.0 Ce Ce6 1 0.99278924 0.34246366 0.21383764 1.0 Ce Ce7 1 0.00721076 0.65753634 0.71383764 1.0 Hf Hf8 1 0.17415022 0.17515201 0.00082850 1.0 Hf Hf9 1 0.82584978 0.82484799 0.50082850 1.0 Hf Hf10 1 0.32495567 0.67412582 0.24996567 1.0 Hf Hf11 1 0.67504433 0.32587418 0.74996567 1.0 Hf Hf12 1 0.14987597 0.99766450 0.37319871 1.0 Hf Hf13 1 0.85012403 0.00233550 0.87319871 1.0 Hf Hf14 1 0.50457380 0.64819452 0.62355144 1.0 Hf Hf15 1 0.35050948 0.49514348 0.87585297 1.0 Hf Hf16 1 0.49542620 0.35180548 0.12355144 1.0 Hf Hf17 1 0.64949052 0.50485652 0.37585297 1.0 Hf Hf18 1 0.99556171 0.14898336 0.62666092 1.0 Hf Hf19 1 0.00443829 0.85101664 0.12666092 1.0 Si Si20 1 0.36286016 0.29661265 0.31682160 1.0 Si Si21 1 0.63713984 0.70338735 0.81682160 1.0 Si Si22 1 0.20581727 0.86368576 0.56441582 1.0 Si Si23 1 0.13824695 0.79679111 0.93516043 1.0 Si Si24 1 0.79418273 0.13631424 0.06441582 1.0 Si Si25 1 0.86175305 0.20320889 0.43516043 1.0 Si Si26 1 0.29750479 0.35971029 0.68393218 1.0 Si Si27 1 0.70249521 0.64028971 0.18393218 1.0 Si Si28 1 0.29697501 0.04781643 0.18594011 1.0 Si Si29 1 0.70302499 0.95218357 0.68594011 1.0 Si Si30 1 0.45200764 0.79614883 0.43525264 1.0 Si Si31 1 0.20571965 0.55058462 0.06353696 1.0 Si Si32 1 0.54799236 0.20385117 0.93525264 1.0 Si Si33 1 0.79428035 0.44941538 0.56353696 1.0 Si Si34 1 0.04856878 0.29372687 0.81512390 1.0 Si Si35 1 0.95143122 0.70627313 0.31512390 1.0