# generated using pymatgen data_Hf5FeTe3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.67230224 _cell_length_b 13.31542917 _cell_length_c 18.01059137 _cell_angle_alpha 90.00427688 _cell_angle_beta 89.99988551 _cell_angle_gamma 89.99985241 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5FeTe3 _chemical_formula_sum 'Hf20 Fe4 Te12' _cell_volume 880.68694402 _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 Hf Hf0 1 0.25000209 0.64121974 0.24389627 1.0 Hf Hf1 1 0.74999466 0.35873469 0.75607630 1.0 Hf Hf2 1 0.75001208 0.14114250 0.25603304 1.0 Hf Hf3 1 0.24999528 0.85888975 0.74395802 1.0 Hf Hf4 1 0.24999661 0.56938903 0.95737317 1.0 Hf Hf5 1 0.74999666 0.43058896 0.04262770 1.0 Hf Hf6 1 0.74999596 0.06934150 0.54265905 1.0 Hf Hf7 1 0.25000018 0.93067436 0.45738284 1.0 Hf Hf8 1 0.75000488 0.84685593 0.58771484 1.0 Hf Hf9 1 0.24999774 0.15317777 0.41232180 1.0 Hf Hf10 1 0.25000223 0.34680361 0.91231068 1.0 Hf Hf11 1 0.74999521 0.65318685 0.08770121 1.0 Hf Hf12 1 0.24999428 0.22435372 0.62230493 1.0 Hf Hf13 1 0.75000594 0.77562045 0.37771073 1.0 Hf Hf14 1 0.74999524 0.72450527 0.87776023 1.0 Hf Hf15 1 0.25000362 0.27550756 0.12223560 1.0 Hf Hf16 1 0.24999444 0.56144481 0.78827966 1.0 Hf Hf17 1 0.74999598 0.43856960 0.21171259 1.0 Hf Hf18 1 0.74999450 0.06143585 0.71174006 1.0 Hf Hf19 1 0.24999869 0.93853936 0.28826393 1.0 Fe Fe20 1 0.24999941 0.52348023 0.13056953 1.0 Fe Fe21 1 0.74999997 0.47650749 0.86944956 1.0 Fe Fe22 1 0.75000146 0.02350366 0.36941433 1.0 Fe Fe23 1 0.25000201 0.97649851 0.63057935 1.0 Te Te24 1 0.24999516 0.44193461 0.64900043 1.0 Te Te25 1 0.74999248 0.55805976 0.35099803 1.0 Te Te26 1 0.74998558 0.94197143 0.85107443 1.0 Te Te27 1 0.25003422 0.05804736 0.14891230 1.0 Te Te28 1 0.74998747 0.69459663 0.70669585 1.0 Te Te29 1 0.24999648 0.30541749 0.29328262 1.0 Te Te30 1 0.24998675 0.19452684 0.79337432 1.0 Te Te31 1 0.75000960 0.80545274 0.20661814 1.0 Te Te32 1 0.24998757 0.78591642 0.00058970 1.0 Te Te33 1 0.75005888 0.21409024 0.99939288 1.0 Te Te34 1 0.74999989 0.28586385 0.49942272 1.0 Te Te35 1 0.24998677 0.71415142 0.50056316 1.0