# generated using pymatgen data_Ga3Ni13Ge6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.89462542 _cell_length_b 7.89462542 _cell_length_c 15.11128300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999514 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ga3Ni13Ge6 _chemical_formula_sum 'Ga9 Ni39 Ge18' _cell_volume 815.63348936 _cell_formula_units_Z 3 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 Ga Ga0 1 0.48995700 0.00000000 0.83333300 1.0 Ga Ga1 1 0.00000000 0.48995700 0.16666700 1.0 Ga Ga2 1 0.51004300 0.51004300 0.50000000 1.0 Ga Ga3 1 0.30550300 0.19414900 0.92005800 1.0 Ga Ga4 1 0.80585100 0.11135400 0.25339200 1.0 Ga Ga5 1 0.88864600 0.69449700 0.58672500 1.0 Ga Ga6 1 0.11135400 0.80585100 0.74660800 1.0 Ga Ga7 1 0.69449700 0.88864600 0.41327500 1.0 Ga Ga8 1 0.19414900 0.30550300 0.07994200 1.0 Ni Ni9 1 0.00828000 0.00000000 0.33333300 1.0 Ni Ni10 1 0.00000000 0.00828000 0.66666700 1.0 Ni Ni11 1 0.99172000 0.99172000 0.00000000 1.0 Ni Ni12 1 0.49175800 0.00000000 0.33333300 1.0 Ni Ni13 1 0.00000000 0.49175800 0.66666700 1.0 Ni Ni14 1 0.50824200 0.50824200 0.00000000 1.0 Ni Ni15 1 0.99823600 0.00000000 0.83333300 1.0 Ni Ni16 1 0.00000000 0.99823600 0.16666700 1.0 Ni Ni17 1 0.00176400 0.00176400 0.50000000 1.0 Ni Ni18 1 0.50234500 0.99671900 0.99828100 1.0 Ni Ni19 1 0.00328100 0.50562600 0.33161400 1.0 Ni Ni20 1 0.49437400 0.49765500 0.66494800 1.0 Ni Ni21 1 0.50562600 0.00328100 0.66838600 1.0 Ni Ni22 1 0.49765500 0.49437400 0.33505200 1.0 Ni Ni23 1 0.99671900 0.50234500 0.00171900 1.0 Ni Ni24 1 0.49675300 0.00222900 0.16631300 1.0 Ni Ni25 1 0.99777100 0.49452500 0.49964700 1.0 Ni Ni26 1 0.50547500 0.50324700 0.83298000 1.0 Ni Ni27 1 0.49452500 0.99777100 0.50035300 1.0 Ni Ni28 1 0.50324700 0.50547500 0.16702000 1.0 Ni Ni29 1 0.00222900 0.49675300 0.83368700 1.0 Ni Ni30 1 0.67958400 0.34215500 0.24627000 1.0 Ni Ni31 1 0.65784500 0.33742900 0.57960300 1.0 Ni Ni32 1 0.66257100 0.32041600 0.91293600 1.0 Ni Ni33 1 0.33742900 0.65784500 0.42039700 1.0 Ni Ni34 1 0.32041600 0.66257100 0.08706400 1.0 Ni Ni35 1 0.34215500 0.67958400 0.75373000 1.0 Ni Ni36 1 0.34097500 0.18170000 0.42640700 1.0 Ni Ni37 1 0.81830000 0.15927500 0.75974000 1.0 Ni Ni38 1 0.84072500 0.65902500 0.09307300 1.0 Ni Ni39 1 0.15927500 0.81830000 0.24026000 1.0 Ni Ni40 1 0.65902500 0.84072500 0.90692700 1.0 Ni Ni41 1 0.18170000 0.34097500 0.57359300 1.0 Ni Ni42 1 0.34066000 0.16482000 0.75098900 1.0 Ni Ni43 1 0.83518000 0.17584000 0.08432200 1.0 Ni Ni44 1 0.82416000 0.65934000 0.41765600 1.0 Ni Ni45 1 0.17584000 0.83518000 0.91567800 1.0 Ni Ni46 1 0.65934000 0.82416000 0.58234400 1.0 Ni Ni47 1 0.16482000 0.34066000 0.24901100 1.0 Ge Ge48 1 0.61321300 0.30629000 0.07772400 1.0 Ge Ge49 1 0.69371000 0.30692300 0.41105700 1.0 Ge Ge50 1 0.69307700 0.38678700 0.74439100 1.0 Ge Ge51 1 0.30692300 0.69371000 0.58894300 1.0 Ge Ge52 1 0.38678700 0.69307700 0.25560900 1.0 Ge Ge53 1 0.30629000 0.61321300 0.92227600 1.0 Ge Ge54 1 0.33387400 0.16713300 0.25214700 1.0 Ge Ge55 1 0.83286700 0.16674100 0.58548000 1.0 Ge Ge56 1 0.83325900 0.66612600 0.91881300 1.0 Ge Ge57 1 0.16674100 0.83286700 0.41452000 1.0 Ge Ge58 1 0.66612600 0.83325900 0.08118700 1.0 Ge Ge59 1 0.16713300 0.33387400 0.74785300 1.0 Ge Ge60 1 0.30711800 0.11372100 0.58948400 1.0 Ge Ge61 1 0.88627900 0.19339600 0.92281800 1.0 Ge Ge62 1 0.80660400 0.69288200 0.25615100 1.0 Ge Ge63 1 0.19339600 0.88627900 0.07718200 1.0 Ge Ge64 1 0.69288200 0.80660400 0.74384900 1.0 Ge Ge65 1 0.11372100 0.30711800 0.41051600 1.0