# generated using pymatgen data_Nb4Cr7Si8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.85469600 _cell_length_b 13.23100900 _cell_length_c 15.80994100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4Cr7Si8 _chemical_formula_sum 'Nb16 Cr28 Si32' _cell_volume 1015.51245374 _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 Nb Nb0 1 0.25000000 0.56452400 0.30464900 1.0 Nb Nb1 1 0.25000000 0.06452400 0.19535100 1.0 Nb Nb2 1 0.75000000 0.43547600 0.69535100 1.0 Nb Nb3 1 0.75000000 0.93547600 0.80464900 1.0 Nb Nb4 1 0.25000000 0.74720600 0.02672400 1.0 Nb Nb5 1 0.25000000 0.24720600 0.47327600 1.0 Nb Nb6 1 0.75000000 0.25279400 0.97327600 1.0 Nb Nb7 1 0.75000000 0.75279400 0.52672400 1.0 Nb Nb8 1 0.25000000 0.86603600 0.45788100 1.0 Nb Nb9 1 0.25000000 0.36603600 0.04211900 1.0 Nb Nb10 1 0.75000000 0.13396400 0.54211900 1.0 Nb Nb11 1 0.75000000 0.63396400 0.95788100 1.0 Nb Nb12 1 0.25000000 0.62109700 0.50546700 1.0 Nb Nb13 1 0.25000000 0.12109700 0.99453300 1.0 Nb Nb14 1 0.75000000 0.37890300 0.49453300 1.0 Nb Nb15 1 0.75000000 0.87890300 0.00546700 1.0 Cr Cr16 1 0.25000000 0.81242400 0.74961800 1.0 Cr Cr17 1 0.25000000 0.31242400 0.75038200 1.0 Cr Cr18 1 0.75000000 0.18757600 0.25038200 1.0 Cr Cr19 1 0.75000000 0.68757600 0.24961800 1.0 Cr Cr20 1 0.01134700 0.55910800 0.12289900 1.0 Cr Cr21 1 0.48865300 0.05910800 0.37710100 1.0 Cr Cr22 1 0.51134700 0.44089200 0.87710100 1.0 Cr Cr23 1 0.98865300 0.94089200 0.62289900 1.0 Cr Cr24 1 0.98865300 0.44089200 0.87710100 1.0 Cr Cr25 1 0.51134700 0.94089200 0.62289900 1.0 Cr Cr26 1 0.48865300 0.55910800 0.12289900 1.0 Cr Cr27 1 0.01134700 0.05910800 0.37710100 1.0 Cr Cr28 1 0.99008600 0.86374500 0.17601900 1.0 Cr Cr29 1 0.50991400 0.36374500 0.32398100 1.0 Cr Cr30 1 0.49008600 0.13625500 0.82398100 1.0 Cr Cr31 1 0.00991400 0.63625500 0.67601900 1.0 Cr Cr32 1 0.00991400 0.13625500 0.82398100 1.0 Cr Cr33 1 0.49008600 0.63625500 0.67601900 1.0 Cr Cr34 1 0.50991400 0.86374500 0.17601900 1.0 Cr Cr35 1 0.99008600 0.36374500 0.32398100 1.0 Cr Cr36 1 0.25000000 0.63460200 0.84450300 1.0 Cr Cr37 1 0.25000000 0.13460200 0.65549700 1.0 Cr Cr38 1 0.75000000 0.36539800 0.15549700 1.0 Cr Cr39 1 0.75000000 0.86539800 0.34450300 1.0 Cr Cr40 1 0.25000000 0.95245500 0.90467100 1.0 Cr Cr41 1 0.25000000 0.45245500 0.59532900 1.0 Cr Cr42 1 0.75000000 0.04754500 0.09532900 1.0 Cr Cr43 1 0.75000000 0.54754500 0.40467100 1.0 Si Si44 1 0.25000000 0.94468800 0.06194500 1.0 Si Si45 1 0.25000000 0.44468800 0.43805500 1.0 Si Si46 1 0.75000000 0.05531200 0.93805500 1.0 Si Si47 1 0.75000000 0.55531200 0.56194500 1.0 Si Si48 1 0.99716900 0.71491800 0.37821600 1.0 Si Si49 1 0.50283100 0.21491800 0.12178400 1.0 Si Si50 1 0.49716900 0.28508200 0.62178400 1.0 Si Si51 1 0.00283100 0.78508200 0.87821600 1.0 Si Si52 1 0.00283100 0.28508200 0.62178400 1.0 Si Si53 1 0.49716900 0.78508200 0.87821600 1.0 Si Si54 1 0.50283100 0.71491800 0.37821600 1.0 Si Si55 1 0.99716900 0.21491800 0.12178400 1.0 Si Si56 1 0.25000000 0.54942400 0.98163000 1.0 Si Si57 1 0.25000000 0.04942400 0.51837000 1.0 Si Si58 1 0.75000000 0.45057600 0.01837000 1.0 Si Si59 1 0.75000000 0.95057600 0.48163000 1.0 Si Si60 1 0.25000000 0.77882600 0.60494100 1.0 Si Si61 1 0.25000000 0.27882600 0.89505900 1.0 Si Si62 1 0.75000000 0.22117400 0.39505900 1.0 Si Si63 1 0.75000000 0.72117400 0.10494100 1.0 Si Si64 1 0.25000000 0.91039700 0.30180300 1.0 Si Si65 1 0.25000000 0.41039700 0.19819700 1.0 Si Si66 1 0.75000000 0.08960300 0.69819700 1.0 Si Si67 1 0.75000000 0.58960300 0.80180300 1.0 Si Si68 1 0.25000000 0.99610400 0.75207000 1.0 Si Si69 1 0.25000000 0.49610400 0.74793000 1.0 Si Si70 1 0.75000000 0.00389600 0.24793000 1.0 Si Si71 1 0.75000000 0.50389600 0.25207000 1.0 Si Si72 1 0.25000000 0.70856900 0.19467000 1.0 Si Si73 1 0.25000000 0.20856900 0.30533000 1.0 Si Si74 1 0.75000000 0.29143100 0.80533000 1.0 Si Si75 1 0.75000000 0.79143100 0.69467000 1.0