# generated using pymatgen data_BaHo(NbS2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.85740741 _cell_length_b 5.85740784 _cell_length_c 14.80813467 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000324 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaHo(NbS2)6 _chemical_formula_sum 'Ba1 Ho1 Nb6 S12' _cell_volume 439.98905085 _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 Ba Ba0 1 0.00000000 0.00000000 0.50000000 1.0 Ho Ho1 1 0.00000000 0.00000000 0.00000000 1.0 Nb Nb2 1 0.00000000 0.00000000 0.76859016 1.0 Nb Nb3 1 0.00000000 0.00000000 0.23140984 1.0 Nb Nb4 1 0.33333300 0.66666700 0.22994976 1.0 Nb Nb5 1 0.66666700 0.33333300 0.77005024 1.0 Nb Nb6 1 0.66666700 0.33333300 0.22994976 1.0 Nb Nb7 1 0.33333300 0.66666700 0.77005024 1.0 S S8 1 0.33568074 1.00000000 0.12431721 1.0 S S9 1 1.00000000 0.33568074 0.12431721 1.0 S S10 1 0.66431926 0.66431926 0.12431721 1.0 S S11 1 0.33856147 0.33856147 0.66428073 1.0 S S12 1 0.66143853 0.66143853 0.33571927 1.0 S S13 1 0.66143853 0.00000000 0.66428073 1.0 S S14 1 0.00000000 0.66143853 0.66428073 1.0 S S15 1 0.00000000 0.66431926 0.87568279 1.0 S S16 1 0.33568074 0.33568074 0.87568279 1.0 S S17 1 0.00000000 0.33856147 0.33571927 1.0 S S18 1 0.33856147 1.00000000 0.33571927 1.0 S S19 1 0.66431926 0.00000000 0.87568279 1.0