# generated using pymatgen data_Ta3Nb(SiH)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.10546527 _cell_length_b 5.10546567 _cell_length_c 5.10036492 _cell_angle_alpha 105.10321959 _cell_angle_beta 105.10322209 _cell_angle_gamma 118.64642969 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3Nb(SiH)2 _chemical_formula_sum 'Ta3 Nb1 Si2 H2' _cell_volume 100.30931031 _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 Ta Ta0 1 0.83347142 0.33347142 0.16694283 1.0 Ta Ta1 1 0.33256782 0.16812102 0.50068984 1.0 Ta Ta2 1 0.66812102 0.83256782 0.50068984 1.0 Nb Nb3 1 0.16751953 0.66751953 0.83504105 1.0 Si Si4 1 0.25038706 0.25038706 0.00077311 1.0 Si Si5 1 0.75038706 0.75038706 0.00077311 1.0 H H6 1 0.74353229 0.24353229 0.49754610 1.0 H H7 1 0.25401281 0.75401281 0.49754610 1.0