# generated using pymatgen data_Nb13Co40Si31 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 17.15330398 _cell_length_b 17.15330398 _cell_length_c 7.87363400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999992 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb13Co40Si31 _chemical_formula_sum 'Nb26 Co80 Si62' _cell_volume 2006.32563894 _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 Nb Nb0 1 0.72732600 0.72732600 0.70209700 1.0 Nb Nb1 1 0.27267400 0.00000000 0.70209700 1.0 Nb Nb2 1 0.00000000 0.27267400 0.70209700 1.0 Nb Nb3 1 0.27267400 0.27267400 0.70209700 1.0 Nb Nb4 1 0.72732600 0.00000000 0.70209700 1.0 Nb Nb5 1 0.00000000 0.72732600 0.70209700 1.0 Nb Nb6 1 0.27267400 0.27267400 0.29790300 1.0 Nb Nb7 1 0.72732600 0.00000000 0.29790300 1.0 Nb Nb8 1 0.00000000 0.72732600 0.29790300 1.0 Nb Nb9 1 0.72732600 0.72732600 0.29790300 1.0 Nb Nb10 1 0.27267400 0.00000000 0.29790300 1.0 Nb Nb11 1 0.00000000 0.27267400 0.29790300 1.0 Nb Nb12 1 0.42301900 0.57698100 0.50000000 1.0 Nb Nb13 1 0.42301900 0.84603800 0.50000000 1.0 Nb Nb14 1 0.15396200 0.57698100 0.50000000 1.0 Nb Nb15 1 0.57698100 0.42301900 0.50000000 1.0 Nb Nb16 1 0.84603800 0.42301900 0.50000000 1.0 Nb Nb17 1 0.57698100 0.15396200 0.50000000 1.0 Nb Nb18 1 0.75608800 0.24391200 0.00000000 1.0 Nb Nb19 1 0.75608800 0.51217600 0.00000000 1.0 Nb Nb20 1 0.48782400 0.24391200 0.00000000 1.0 Nb Nb21 1 0.24391200 0.75608800 0.00000000 1.0 Nb Nb22 1 0.51217600 0.75608800 0.00000000 1.0 Nb Nb23 1 0.24391200 0.48782400 0.00000000 1.0 Nb Nb24 1 0.00000000 0.00000000 0.80040300 1.0 Nb Nb25 1 0.00000000 0.00000000 0.19959700 1.0 Co Co26 1 0.89712100 0.34225100 0.77120600 1.0 Co Co27 1 0.65774900 0.55487000 0.77120600 1.0 Co Co28 1 0.44513000 0.10287900 0.77120600 1.0 Co Co29 1 0.34225100 0.89712100 0.77120600 1.0 Co Co30 1 0.55487000 0.65774900 0.77120600 1.0 Co Co31 1 0.10287900 0.44513000 0.77120600 1.0 Co Co32 1 0.10287900 0.65774900 0.77120600 1.0 Co Co33 1 0.34225100 0.44513000 0.77120600 1.0 Co Co34 1 0.55487000 0.89712100 0.77120600 1.0 Co Co35 1 0.65774900 0.10287900 0.77120600 1.0 Co Co36 1 0.44513000 0.34225100 0.77120600 1.0 Co Co37 1 0.89712100 0.55487000 0.77120600 1.0 Co Co38 1 0.10287900 0.65774900 0.22879400 1.0 Co Co39 1 0.34225100 0.44513000 0.22879400 1.0 Co Co40 1 0.55487000 0.89712100 0.22879400 1.0 Co Co41 1 0.65774900 0.10287900 0.22879400 1.0 Co Co42 1 0.44513000 0.34225100 0.22879400 1.0 Co Co43 1 0.89712100 0.55487000 0.22879400 1.0 Co Co44 1 0.89712100 0.34225100 0.22879400 1.0 Co Co45 1 0.65774900 0.55487000 0.22879400 1.0 Co Co46 1 0.44513000 0.10287900 0.22879400 1.0 Co Co47 1 0.34225100 0.89712100 0.22879400 1.0 Co Co48 1 0.55487000 0.65774900 0.22879400 1.0 Co Co49 1 0.10287900 0.44513000 0.22879400 1.0 Co Co50 1 0.91452800 0.23555100 0.00000000 1.0 Co Co51 1 0.76444900 0.67897700 0.00000000 1.0 Co Co52 1 0.32102300 0.08547200 0.00000000 1.0 Co Co53 1 0.23555100 0.91452800 0.00000000 1.0 Co Co54 1 0.67897700 0.76444900 0.00000000 1.0 Co Co55 1 0.08547200 0.32102300 0.00000000 1.0 Co Co56 1 0.08547200 0.76444900 0.00000000 1.0 Co Co57 1 0.23555100 0.32102300 0.00000000 1.0 Co Co58 1 0.67897700 0.91452800 0.00000000 1.0 Co Co59 1 0.76444900 0.08547200 0.00000000 1.0 Co Co60 1 0.32102300 0.23555100 0.00000000 1.0 Co Co61 1 0.91452800 0.67897700 0.00000000 1.0 Co Co62 1 0.91123200 0.08876800 0.75665500 1.0 Co Co63 1 0.91123200 0.82246400 0.75665500 1.0 Co Co64 1 0.17753600 0.08876800 0.75665500 1.0 Co Co65 1 0.08876800 0.91123200 0.75665500 1.0 Co Co66 1 0.82246400 0.91123200 0.75665500 1.0 Co Co67 1 0.08876800 0.17753600 0.75665500 1.0 Co Co68 1 0.08876800 0.91123200 0.24334500 1.0 Co Co69 1 0.08876800 0.17753600 0.24334500 1.0 Co Co70 1 0.82246400 0.91123200 0.24334500 1.0 Co Co71 1 0.91123200 0.08876800 0.24334500 1.0 Co Co72 1 0.17753600 0.08876800 0.24334500 1.0 Co Co73 1 0.91123200 0.82246400 0.24334500 1.0 Co Co74 1 0.73835200 0.26164800 0.65736200 1.0 Co Co75 1 0.73835200 0.47670400 0.65736200 1.0 Co Co76 1 0.52329600 0.26164800 0.65736200 1.0 Co Co77 1 0.26164800 0.73835200 0.65736200 1.0 Co Co78 1 0.47670400 0.73835200 0.65736200 1.0 Co Co79 1 0.26164800 0.52329600 0.65736200 1.0 Co Co80 1 0.26164800 0.73835200 0.34263800 1.0 Co Co81 1 0.26164800 0.52329600 0.34263800 1.0 Co Co82 1 0.47670400 0.73835200 0.34263800 1.0 Co Co83 1 0.73835200 0.26164800 0.34263800 1.0 Co Co84 1 0.52329600 0.26164800 0.34263800 1.0 Co Co85 1 0.73835200 0.47670400 0.34263800 1.0 Co Co86 1 0.85824000 0.14176000 0.50000000 1.0 Co Co87 1 0.85824000 0.71648000 0.50000000 1.0 Co Co88 1 0.28352000 0.14176000 0.50000000 1.0 Co Co89 1 0.14176000 0.85824000 0.50000000 1.0 Co Co90 1 0.71648000 0.85824000 0.50000000 1.0 Co Co91 1 0.14176000 0.28352000 0.50000000 1.0 Co Co92 1 0.45549900 0.54450100 0.00000000 1.0 Co Co93 1 0.45549900 0.91099800 0.00000000 1.0 Co Co94 1 0.08900200 0.54450100 0.00000000 1.0 Co Co95 1 0.54450100 0.45549900 0.00000000 1.0 Co Co96 1 0.91099800 0.45549900 0.00000000 1.0 Co Co97 1 0.54450100 0.08900200 0.00000000 1.0 Co Co98 1 0.58152000 0.58152000 0.50000000 1.0 Co Co99 1 0.41848000 0.00000000 0.50000000 1.0 Co Co100 1 0.00000000 0.41848000 0.50000000 1.0 Co Co101 1 0.41848000 0.41848000 0.50000000 1.0 Co Co102 1 0.58152000 0.00000000 0.50000000 1.0 Co Co103 1 0.00000000 0.58152000 0.50000000 1.0 Co Co104 1 0.66666700 0.33333300 0.00000000 1.0 Co Co105 1 0.33333300 0.66666700 0.00000000 1.0 Si Si106 1 0.87153100 0.28223300 0.50000000 1.0 Si Si107 1 0.71776700 0.58929800 0.50000000 1.0 Si Si108 1 0.41070200 0.12846900 0.50000000 1.0 Si Si109 1 0.28223300 0.87153100 0.50000000 1.0 Si Si110 1 0.58929800 0.71776700 0.50000000 1.0 Si Si111 1 0.12846900 0.41070200 0.50000000 1.0 Si Si112 1 0.12846900 0.71776700 0.50000000 1.0 Si Si113 1 0.28223300 0.41070200 0.50000000 1.0 Si Si114 1 0.58929800 0.87153100 0.50000000 1.0 Si Si115 1 0.71776700 0.12846900 0.50000000 1.0 Si Si116 1 0.41070200 0.28223300 0.50000000 1.0 Si Si117 1 0.87153100 0.58929800 0.50000000 1.0 Si Si118 1 0.82122600 0.17877400 0.76469300 1.0 Si Si119 1 0.82122600 0.64245300 0.76469300 1.0 Si Si120 1 0.35754700 0.17877400 0.76469300 1.0 Si Si121 1 0.17877400 0.82122600 0.76469300 1.0 Si Si122 1 0.64245300 0.82122600 0.76469300 1.0 Si Si123 1 0.17877400 0.35754700 0.76469300 1.0 Si Si124 1 0.17877400 0.82122600 0.23530700 1.0 Si Si125 1 0.17877400 0.35754700 0.23530700 1.0 Si Si126 1 0.64245300 0.82122600 0.23530700 1.0 Si Si127 1 0.82122600 0.17877400 0.23530700 1.0 Si Si128 1 0.35754700 0.17877400 0.23530700 1.0 Si Si129 1 0.82122600 0.64245300 0.23530700 1.0 Si Si130 1 0.39507000 0.60493000 0.81849300 1.0 Si Si131 1 0.39507000 0.79014000 0.81849300 1.0 Si Si132 1 0.20986000 0.60493000 0.81849300 1.0 Si Si133 1 0.60493000 0.39507000 0.81849300 1.0 Si Si134 1 0.79014000 0.39507000 0.81849300 1.0 Si Si135 1 0.60493000 0.20986000 0.81849300 1.0 Si Si136 1 0.60493000 0.39507000 0.18150700 1.0 Si Si137 1 0.60493000 0.20986000 0.18150700 1.0 Si Si138 1 0.79014000 0.39507000 0.18150700 1.0 Si Si139 1 0.39507000 0.60493000 0.18150700 1.0 Si Si140 1 0.20986000 0.60493000 0.18150700 1.0 Si Si141 1 0.39507000 0.79014000 0.18150700 1.0 Si Si142 1 0.85468500 0.85468500 0.50000000 1.0 Si Si143 1 0.14531500 0.00000000 0.50000000 1.0 Si Si144 1 0.00000000 0.14531500 0.50000000 1.0 Si Si145 1 0.14531500 0.14531500 0.50000000 1.0 Si Si146 1 0.85468500 0.00000000 0.50000000 1.0 Si Si147 1 0.00000000 0.85468500 0.50000000 1.0 Si Si148 1 0.83875300 0.83875300 0.00000000 1.0 Si Si149 1 0.16124700 0.00000000 0.00000000 1.0 Si Si150 1 0.00000000 0.16124700 0.00000000 1.0 Si Si151 1 0.16124700 0.16124700 0.00000000 1.0 Si Si152 1 0.83875300 0.00000000 0.00000000 1.0 Si Si153 1 0.00000000 0.83875300 0.00000000 1.0 Si Si154 1 0.61232800 0.61232800 0.00000000 1.0 Si Si155 1 0.38767200 0.00000000 0.00000000 1.0 Si Si156 1 0.00000000 0.38767200 0.00000000 1.0 Si Si157 1 0.38767200 0.38767200 0.00000000 1.0 Si Si158 1 0.61232800 0.00000000 0.00000000 1.0 Si Si159 1 0.00000000 0.61232800 0.00000000 1.0 Si Si160 1 0.50000000 0.50000000 0.73907200 1.0 Si Si161 1 0.50000000 0.00000000 0.73907200 1.0 Si Si162 1 0.00000000 0.50000000 0.73907200 1.0 Si Si163 1 0.50000000 0.50000000 0.26092800 1.0 Si Si164 1 0.50000000 0.00000000 0.26092800 1.0 Si Si165 1 0.00000000 0.50000000 0.26092800 1.0 Si Si166 1 0.66666700 0.33333300 0.50000000 1.0 Si Si167 1 0.33333300 0.66666700 0.50000000 1.0