# generated using pymatgen data_Nb4Cr7Si8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.85997200 _cell_length_b 13.23112700 _cell_length_c 15.91697200 _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 1023.50756623 _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 0.86678900 0.45763400 1.0 Nb Nb1 1 0.25000000 0.36678900 0.04236600 1.0 Nb Nb2 1 0.75000000 0.13321100 0.54236600 1.0 Nb Nb3 1 0.75000000 0.63321100 0.95763400 1.0 Nb Nb4 1 0.25000000 0.75069300 0.02670200 1.0 Nb Nb5 1 0.25000000 0.25069300 0.47329800 1.0 Nb Nb6 1 0.75000000 0.24930700 0.97329800 1.0 Nb Nb7 1 0.75000000 0.74930700 0.52670200 1.0 Nb Nb8 1 0.25000000 0.56790200 0.30158900 1.0 Nb Nb9 1 0.25000000 0.06790200 0.19841100 1.0 Nb Nb10 1 0.75000000 0.43209800 0.69841100 1.0 Nb Nb11 1 0.75000000 0.93209800 0.80158900 1.0 Nb Nb12 1 0.25000000 0.95811700 0.90790500 1.0 Nb Nb13 1 0.25000000 0.45811700 0.59209500 1.0 Nb Nb14 1 0.75000000 0.04188300 0.09209500 1.0 Nb Nb15 1 0.75000000 0.54188300 0.40790500 1.0 Cr Cr16 1 0.00771700 0.56129500 0.12121900 1.0 Cr Cr17 1 0.49228300 0.06129500 0.37878100 1.0 Cr Cr18 1 0.50771700 0.43870500 0.87878100 1.0 Cr Cr19 1 0.99228300 0.93870500 0.62121900 1.0 Cr Cr20 1 0.99228300 0.43870500 0.87878100 1.0 Cr Cr21 1 0.50771700 0.93870500 0.62121900 1.0 Cr Cr22 1 0.49228300 0.56129500 0.12121900 1.0 Cr Cr23 1 0.00771700 0.06129500 0.37878100 1.0 Cr Cr24 1 0.25000000 0.81098700 0.75050500 1.0 Cr Cr25 1 0.25000000 0.31098700 0.74949500 1.0 Cr Cr26 1 0.75000000 0.18901300 0.24949500 1.0 Cr Cr27 1 0.75000000 0.68901300 0.25050500 1.0 Cr Cr28 1 0.99141500 0.86341300 0.17639400 1.0 Cr Cr29 1 0.50858500 0.36341300 0.32360600 1.0 Cr Cr30 1 0.49141500 0.13658700 0.82360600 1.0 Cr Cr31 1 0.00858500 0.63658700 0.67639400 1.0 Cr Cr32 1 0.00858500 0.13658700 0.82360600 1.0 Cr Cr33 1 0.49141500 0.63658700 0.67639400 1.0 Cr Cr34 1 0.50858500 0.86341300 0.17639400 1.0 Cr Cr35 1 0.99141500 0.36341300 0.32360600 1.0 Cr Cr36 1 0.25000000 0.63580700 0.84463000 1.0 Cr Cr37 1 0.25000000 0.13580700 0.65537000 1.0 Cr Cr38 1 0.75000000 0.36419300 0.15537000 1.0 Cr Cr39 1 0.75000000 0.86419300 0.34463000 1.0 Cr Cr40 1 0.25000000 0.62667900 0.50379100 1.0 Cr Cr41 1 0.25000000 0.12667900 0.99620900 1.0 Cr Cr42 1 0.75000000 0.37332100 0.49620900 1.0 Cr Cr43 1 0.75000000 0.87332100 0.00379100 1.0 Si Si44 1 0.25000000 0.91320400 0.30200400 1.0 Si Si45 1 0.25000000 0.41320400 0.19799600 1.0 Si Si46 1 0.75000000 0.08679600 0.69799600 1.0 Si Si47 1 0.75000000 0.58679600 0.80200400 1.0 Si Si48 1 0.25000000 0.94903000 0.06657400 1.0 Si Si49 1 0.25000000 0.44903000 0.43342600 1.0 Si Si50 1 0.75000000 0.05097000 0.93342600 1.0 Si Si51 1 0.75000000 0.55097000 0.56657400 1.0 Si Si52 1 0.25000000 0.55019700 0.98193000 1.0 Si Si53 1 0.25000000 0.05019700 0.51807000 1.0 Si Si54 1 0.75000000 0.44980300 0.01807000 1.0 Si Si55 1 0.75000000 0.94980300 0.48193000 1.0 Si Si56 1 0.00215100 0.71582500 0.38084300 1.0 Si Si57 1 0.49784900 0.21582500 0.11915700 1.0 Si Si58 1 0.50215100 0.28417500 0.61915700 1.0 Si Si59 1 0.99784900 0.78417500 0.88084300 1.0 Si Si60 1 0.99784900 0.28417500 0.61915700 1.0 Si Si61 1 0.50215100 0.78417500 0.88084300 1.0 Si Si62 1 0.49784900 0.71582500 0.38084300 1.0 Si Si63 1 0.00215100 0.21582500 0.11915700 1.0 Si Si64 1 0.25000000 0.99690800 0.74782600 1.0 Si Si65 1 0.25000000 0.49690800 0.75217400 1.0 Si Si66 1 0.75000000 0.00309200 0.25217400 1.0 Si Si67 1 0.75000000 0.50309200 0.24782600 1.0 Si Si68 1 0.25000000 0.70892900 0.19287000 1.0 Si Si69 1 0.25000000 0.20892900 0.30713000 1.0 Si Si70 1 0.75000000 0.29107100 0.80713000 1.0 Si Si71 1 0.75000000 0.79107100 0.69287000 1.0 Si Si72 1 0.25000000 0.77375300 0.60261600 1.0 Si Si73 1 0.25000000 0.27375300 0.89738400 1.0 Si Si74 1 0.75000000 0.22624700 0.39738400 1.0 Si Si75 1 0.75000000 0.72624700 0.10261600 1.0