# generated using pymatgen data_Nb13(Pb3O10)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.65803635 _cell_length_b 7.65803635 _cell_length_c 22.99507197 _cell_angle_alpha 80.41476057 _cell_angle_beta 80.41476057 _cell_angle_gamma 59.99999318 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb13(Pb3O10)5 _chemical_formula_sum 'Nb13 Pb15 O50' _cell_volume 1146.09398810 _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 Nb Nb0 1 0.88870720 0.38895791 0.83362768 1.0 Nb Nb1 1 0.88870720 0.88870720 0.83362768 1.0 Nb Nb2 1 0.38895791 0.88870720 0.83362768 1.0 Nb Nb3 1 0.46139766 0.96428086 0.11292382 1.0 Nb Nb4 1 0.46139766 0.46139766 0.11292382 1.0 Nb Nb5 1 0.96428086 0.46139766 0.11292382 1.0 Nb Nb6 1 0.10226385 0.10226385 0.69320846 1.0 Nb Nb7 1 0.24818128 0.24818128 0.25545615 1.0 Nb Nb8 1 0.31629817 0.81338680 0.55401686 1.0 Nb Nb9 1 0.31629817 0.31629817 0.55401686 1.0 Nb Nb10 1 0.81338680 0.31629817 0.55401686 1.0 Nb Nb11 1 0.52974113 0.52974113 0.41077660 1.0 Nb Nb12 1 0.67527397 0.67527397 0.97417809 1.0 Pb Pb13 1 0.17589007 0.67334656 0.97487331 1.0 Pb Pb14 1 0.17589007 0.17589007 0.97487331 1.0 Pb Pb15 1 0.67334656 0.17589007 0.97487331 1.0 Pb Pb16 1 0.38859356 0.38859356 0.83421933 1.0 Pb Pb17 1 0.96235405 0.96235405 0.11293785 1.0 Pb Pb18 1 0.60170353 0.10337859 0.69321435 1.0 Pb Pb19 1 0.60170353 0.60170353 0.69321435 1.0 Pb Pb20 1 0.10337859 0.60170353 0.69321435 1.0 Pb Pb21 1 0.74622469 0.24453117 0.26301945 1.0 Pb Pb22 1 0.74622469 0.74622469 0.26301945 1.0 Pb Pb23 1 0.24453117 0.74622469 0.26301945 1.0 Pb Pb24 1 0.03001749 0.53174502 0.40822000 1.0 Pb Pb25 1 0.03001749 0.03001749 0.40822000 1.0 Pb Pb26 1 0.53174502 0.03001749 0.40822000 1.0 Pb Pb27 1 0.81548214 0.81548214 0.55355357 1.0 O O28 1 0.53269763 0.91452089 0.02008385 1.0 O O29 1 0.53269763 0.53269763 0.02008385 1.0 O O30 1 0.91452089 0.53269763 0.02008385 1.0 O O31 1 0.58202290 0.58202290 0.25393129 1.0 O O32 1 0.77868210 0.77868210 0.66395371 1.0 O O33 1 0.35275667 0.35275667 0.94173000 1.0 O O34 1 0.17750561 0.55531501 0.08967377 1.0 O O35 1 0.17750561 0.17750561 0.08967377 1.0 O O36 1 0.55531501 0.17750561 0.08967377 1.0 O O37 1 0.39119168 0.02439384 0.19322280 1.0 O O38 1 0.39119168 0.39119168 0.19322280 1.0 O O39 1 0.02439384 0.39119168 0.19322280 1.0 O O40 1 0.60089783 0.22195284 0.57625150 1.0 O O41 1 0.60089783 0.60089783 0.57625150 1.0 O O42 1 0.22195284 0.60089783 0.57625150 1.0 O O43 1 0.75104898 0.37457798 0.12332407 1.0 O O44 1 0.75104898 0.75104898 0.12332407 1.0 O O45 1 0.37457798 0.75104898 0.12332407 1.0 O O46 1 0.85155286 0.85155286 0.44534141 1.0 O O47 1 0.95866324 0.33571429 0.74695924 1.0 O O48 1 0.95866324 0.95866324 0.74695924 1.0 O O49 1 0.33571429 0.95866324 0.74695924 1.0 O O50 1 0.92214053 0.92214053 0.23357841 1.0 O O51 1 0.81933964 0.44258808 0.91873263 1.0 O O52 1 0.81933964 0.81933964 0.91873263 1.0 O O53 1 0.44258808 0.81933964 0.91873263 1.0 O O54 1 0.24517919 0.86429213 0.64534948 1.0 O O55 1 0.24517919 0.24517919 0.64534948 1.0 O O56 1 0.86429213 0.24517919 0.64534948 1.0 O O57 1 0.99656517 0.99656517 0.01030450 1.0 O O58 1 0.10382663 0.49900587 0.29334086 1.0 O O59 1 0.10382663 0.10382663 0.29334086 1.0 O O60 1 0.49900587 0.10382663 0.29334086 1.0 O O61 1 0.38613151 0.75530797 0.47242901 1.0 O O62 1 0.38613151 0.38613151 0.47242901 1.0 O O63 1 0.75530797 0.38613151 0.47242901 1.0 O O64 1 0.67300682 0.28387798 0.37010838 1.0 O O65 1 0.67300682 0.67300682 0.37010838 1.0 O O66 1 0.28387798 0.67300682 0.37010838 1.0 O O67 1 0.42518509 0.42518509 0.72444474 1.0 O O68 1 0.17538124 0.79893446 0.85030306 1.0 O O69 1 0.17538124 0.17538124 0.85030306 1.0 O O70 1 0.79893446 0.17538124 0.85030306 1.0 O O71 1 0.60214996 0.98009997 0.81560010 1.0 O O72 1 0.60214996 0.60214996 0.81560010 1.0 O O73 1 0.98009997 0.60214996 0.81560010 1.0 O O74 1 0.02711292 0.40354083 0.54223334 1.0 O O75 1 0.02711292 0.02711292 0.54223334 1.0 O O76 1 0.40354083 0.02711292 0.54223334 1.0 O O77 1 0.19753225 0.19753225 0.40740326 1.0