# generated using pymatgen data_Tb8Ti9Nb3Si16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.05915619 _cell_length_b 7.05915614 _cell_length_c 13.00356980 _cell_angle_alpha 90.01261028 _cell_angle_beta 89.98738928 _cell_angle_gamma 89.95575301 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb8Ti9Nb3Si16 _chemical_formula_sum 'Tb8 Ti9 Nb3 Si16' _cell_volume 647.98957924 _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 Tb Tb0 1 0.33930159 0.00146506 0.46628994 1.0 Tb Tb1 1 0.49846690 0.83951455 0.71692478 1.0 Tb Tb2 1 0.50091227 0.15957019 0.21645806 1.0 Tb Tb3 1 0.83951455 0.49846690 0.28307522 1.0 Tb Tb4 1 0.15957019 0.50091227 0.78354194 1.0 Tb Tb5 1 0.66023735 0.99918455 0.96635831 1.0 Tb Tb6 1 0.00146506 0.33930159 0.53371006 1.0 Tb Tb7 1 0.99918455 0.66023735 0.03364169 1.0 Ti Ti8 1 0.67183695 0.67183695 0.50000000 1.0 Ti Ti9 1 0.15332250 0.01018661 0.87583360 1.0 Ti Ti10 1 0.48916368 0.65385715 0.12657137 1.0 Ti Ti11 1 0.51049797 0.34609787 0.62719604 1.0 Ti Ti12 1 0.65385715 0.48916368 0.87342863 1.0 Ti Ti13 1 0.34609787 0.51049797 0.37280396 1.0 Ti Ti14 1 0.84831449 0.99124709 0.37513670 1.0 Ti Ti15 1 0.01018661 0.15332250 0.12416640 1.0 Ti Ti16 1 0.99124709 0.84831449 0.62486330 1.0 Nb Nb17 1 0.32734706 0.32734706 0.00000000 1.0 Nb Nb18 1 0.17237920 0.82740369 0.25014517 1.0 Nb Nb19 1 0.82740369 0.17237920 0.74985483 1.0 Si Si20 1 0.20354765 0.12947741 0.68473049 1.0 Si Si21 1 0.37084540 0.70320662 0.93504643 1.0 Si Si22 1 0.62923618 0.29816360 0.43543481 1.0 Si Si23 1 0.70320662 0.37084540 0.06495357 1.0 Si Si24 1 0.29816360 0.62923618 0.56456519 1.0 Si Si25 1 0.79665877 0.87053759 0.18508974 1.0 Si Si26 1 0.12947741 0.20354765 0.31526951 1.0 Si Si27 1 0.87053759 0.79665877 0.81491026 1.0 Si Si28 1 0.29191223 0.95337131 0.06293406 1.0 Si Si29 1 0.54748007 0.79130758 0.31431352 1.0 Si Si30 1 0.45284965 0.20800487 0.81315376 1.0 Si Si31 1 0.79130758 0.54748007 0.68568648 1.0 Si Si32 1 0.20800487 0.45284965 0.18684624 1.0 Si Si33 1 0.70808033 0.04501304 0.56281249 1.0 Si Si34 1 0.95337131 0.29191223 0.93706594 1.0 Si Si35 1 0.04501304 0.70808033 0.43718751 1.0