# generated using pymatgen data_Tm5(SiB4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.14270331 _cell_length_b 7.14270331 _cell_length_c 7.92450598 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5(SiB4)2 _chemical_formula_sum 'Tm10 Si4 B16' _cell_volume 404.29411490 _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 Tm Tm0 1 0.68071681 0.18071681 0.22361661 1.0 Tm Tm1 1 0.31928319 0.81928319 0.77638339 1.0 Tm Tm2 1 0.31928319 0.81928319 0.22361661 1.0 Tm Tm3 1 0.81928319 0.68071681 0.22361661 1.0 Tm Tm4 1 0.81928319 0.68071681 0.77638339 1.0 Tm Tm5 1 0.68071681 0.18071681 0.77638339 1.0 Tm Tm6 1 0.18071681 0.31928319 0.77638339 1.0 Tm Tm7 1 0.18071681 0.31928319 0.22361661 1.0 Tm Tm8 1 0.00000000 0.00000000 0.50000000 1.0 Tm Tm9 1 0.50000000 0.50000000 0.50000000 1.0 Si Si10 1 0.11630258 0.61630258 0.50000000 1.0 Si Si11 1 0.88369742 0.38369742 0.50000000 1.0 Si Si12 1 0.38369742 0.11630258 0.50000000 1.0 Si Si13 1 0.61630258 0.88369742 0.50000000 1.0 B B14 1 0.17255638 0.03939461 0.00000000 1.0 B B15 1 0.82744362 0.96060539 0.00000000 1.0 B B16 1 0.96060539 0.17255638 0.00000000 1.0 B B17 1 0.32744362 0.53939461 0.00000000 1.0 B B18 1 0.03939461 0.82744362 0.00000000 1.0 B B19 1 0.67255638 0.46060539 0.00000000 1.0 B B20 1 0.53939461 0.67255638 0.00000000 1.0 B B21 1 0.46060539 0.32744362 0.00000000 1.0 B B22 1 0.09034872 0.59034872 0.00000000 1.0 B B23 1 0.90965128 0.40965128 0.00000000 1.0 B B24 1 0.40965128 0.09034872 0.00000000 1.0 B B25 1 0.59034872 0.90965128 0.00000000 1.0 B B26 1 0.00000000 0.00000000 0.16600699 1.0 B B27 1 0.00000000 0.00000000 0.83399301 1.0 B B28 1 0.50000000 0.50000000 0.83399301 1.0 B B29 1 0.50000000 0.50000000 0.16600699 1.0