# generated using pymatgen data_Y2Nb3Si4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.87453210 _cell_length_b 7.09656529 _cell_length_c 13.39932658 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y2Nb3Si4 _chemical_formula_sum 'Y8 Nb12 Si16' _cell_volume 653.69373035 _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 Y Y0 1 0.99541817 0.17154299 0.40306124 1.0 Y Y1 1 0.49541817 0.32845701 0.09693876 1.0 Y Y2 1 0.50458183 0.67154299 0.59693876 1.0 Y Y3 1 0.00458183 0.82845701 0.90306124 1.0 Y Y4 1 0.00458183 0.82845701 0.59693876 1.0 Y Y5 1 0.50458183 0.67154299 0.90306124 1.0 Y Y6 1 0.49541817 0.32845701 0.40306124 1.0 Y Y7 1 0.99541817 0.17154299 0.09693876 1.0 Nb Nb8 1 0.33718774 0.82308330 0.12598217 1.0 Nb Nb9 1 0.83718774 0.67691670 0.37401783 1.0 Nb Nb10 1 0.66281226 0.17691670 0.62598217 1.0 Nb Nb11 1 0.16281226 0.32308330 0.87401783 1.0 Nb Nb12 1 0.16281226 0.32308330 0.62598217 1.0 Nb Nb13 1 0.66281226 0.17691670 0.87401783 1.0 Nb Nb14 1 0.33849731 0.00922951 0.75000000 1.0 Nb Nb15 1 0.83718774 0.67691670 0.12598217 1.0 Nb Nb16 1 0.66150269 0.99077049 0.25000000 1.0 Nb Nb17 1 0.16150269 0.50922951 0.25000000 1.0 Nb Nb18 1 0.83849731 0.49077049 0.75000000 1.0 Nb Nb19 1 0.33718774 0.82308330 0.37401783 1.0 Si Si20 1 0.33880294 0.03662099 0.54064055 1.0 Si Si21 1 0.83880294 0.46337901 0.95935945 1.0 Si Si22 1 0.66119706 0.96337901 0.04064055 1.0 Si Si23 1 0.16119706 0.53662099 0.45935945 1.0 Si Si24 1 0.16119706 0.53662099 0.04064055 1.0 Si Si25 1 0.66119706 0.96337901 0.45935945 1.0 Si Si26 1 0.83880294 0.46337901 0.54064055 1.0 Si Si27 1 0.33880294 0.03662099 0.95935945 1.0 Si Si28 1 0.79509569 0.37677372 0.25000000 1.0 Si Si29 1 0.29509569 0.12322628 0.25000000 1.0 Si Si30 1 0.70490431 0.87677372 0.75000000 1.0 Si Si31 1 0.20490431 0.62322628 0.75000000 1.0 Si Si32 1 0.04072018 0.87786860 0.25000000 1.0 Si Si33 1 0.54072018 0.62213140 0.25000000 1.0 Si Si34 1 0.45927982 0.37786860 0.75000000 1.0 Si Si35 1 0.95927982 0.12213140 0.75000000 1.0