# generated using pymatgen data_Sr3Nb5O15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.00064600 _cell_length_b 12.68441200 _cell_length_c 12.68441200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr3Nb5O15 _chemical_formula_sum 'Sr6 Nb10 O30' _cell_volume 643.68116887 _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 Sr Sr0 1 0.99719200 0.00000000 0.00000000 1.0 Sr Sr1 1 0.99719200 0.50000000 0.50000000 1.0 Sr Sr2 1 0.01075300 0.66205300 0.16205300 1.0 Sr Sr3 1 0.01075300 0.33794700 0.83794700 1.0 Sr Sr4 1 0.01075300 0.83794700 0.66205300 1.0 Sr Sr5 1 0.01075300 0.16205300 0.33794700 1.0 Nb Nb6 1 0.50275700 0.50000000 0.00000000 1.0 Nb Nb7 1 0.50275700 0.00000000 0.50000000 1.0 Nb Nb8 1 0.49995400 0.21066800 0.07889500 1.0 Nb Nb9 1 0.49995400 0.78933200 0.92110500 1.0 Nb Nb10 1 0.49995400 0.92110500 0.21066800 1.0 Nb Nb11 1 0.49995400 0.71066800 0.42110500 1.0 Nb Nb12 1 0.49995400 0.07889500 0.78933200 1.0 Nb Nb13 1 0.49995400 0.28933200 0.57889500 1.0 Nb Nb14 1 0.49995400 0.42110500 0.28933200 1.0 Nb Nb15 1 0.49995400 0.57889500 0.71066800 1.0 O O16 1 0.99941200 0.20627000 0.07910600 1.0 O O17 1 0.99941200 0.79373000 0.92089400 1.0 O O18 1 0.99941200 0.92089400 0.20627000 1.0 O O19 1 0.99941200 0.70627000 0.42089400 1.0 O O20 1 0.99941200 0.07910600 0.79373000 1.0 O O21 1 0.99941200 0.29373000 0.57910600 1.0 O O22 1 0.99941200 0.42089400 0.29373000 1.0 O O23 1 0.99941200 0.57910600 0.70627000 1.0 O O24 1 0.49857400 0.06419100 0.13545000 1.0 O O25 1 0.49857400 0.93580900 0.86455000 1.0 O O26 1 0.49857400 0.86455000 0.06419100 1.0 O O27 1 0.49857400 0.56419100 0.36455000 1.0 O O28 1 0.49857400 0.13545000 0.93580900 1.0 O O29 1 0.49857400 0.43580900 0.63545000 1.0 O O30 1 0.49857400 0.36455000 0.43580900 1.0 O O31 1 0.49857400 0.63545000 0.56419100 1.0 O O32 1 0.00038200 0.50000000 0.00000000 1.0 O O33 1 0.00038200 0.00000000 0.50000000 1.0 O O34 1 0.49996400 0.22692700 0.72692700 1.0 O O35 1 0.49996400 0.77307300 0.27307300 1.0 O O36 1 0.49996400 0.27307300 0.22692700 1.0 O O37 1 0.49996400 0.72692700 0.77307300 1.0 O O38 1 0.49886900 0.01101500 0.34108100 1.0 O O39 1 0.49886900 0.98898500 0.65891900 1.0 O O40 1 0.49886900 0.65891900 0.01101500 1.0 O O41 1 0.49886900 0.51101500 0.15891900 1.0 O O42 1 0.49886900 0.34108100 0.98898500 1.0 O O43 1 0.49886900 0.48898500 0.84108100 1.0 O O44 1 0.49886900 0.15891900 0.48898500 1.0 O O45 1 0.49886900 0.84108100 0.51101500 1.0