# generated using pymatgen data_K3Ga13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.40243350 _cell_length_b 8.65512330 _cell_length_c 28.26080679 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 111.70721068 _symmetry_Int_Tables_number 1 _chemical_formula_structural K3Ga13 _chemical_formula_sum 'K12 Ga52' _cell_volume 1454.98602449 _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 K K0 1 0.21334800 0.42669700 0.58606814 1.0 K K1 1 0.78665200 0.57330300 0.41393186 1.0 K K2 1 0.36324541 0.72649182 0.82040671 1.0 K K3 1 0.98721405 0.97442810 0.86088611 1.0 K K4 1 0.63675459 0.27350818 0.32040671 1.0 K K5 1 0.36324541 0.72649182 0.67959329 1.0 K K6 1 0.01278595 0.02557190 0.36088611 1.0 K K7 1 0.01278595 0.02557190 0.13911389 1.0 K K8 1 0.21334800 0.42669700 0.91393186 1.0 K K9 1 0.98721405 0.97442810 0.63911389 1.0 K K10 1 0.63675459 0.27350818 0.17959329 1.0 K K11 1 0.78665200 0.57330300 0.08606814 1.0 Ga Ga12 1 0.20171516 0.40343233 0.07297936 1.0 Ga Ga13 1 0.24349711 0.09921672 0.53534564 1.0 Ga Ga14 1 0.40590436 0.21987281 0.04702604 1.0 Ga Ga15 1 0.97196123 0.34458843 0.79678685 1.0 Ga Ga16 1 0.74225861 0.48451721 0.84308084 1.0 Ga Ga17 1 0.34269487 0.68538873 0.03166066 1.0 Ga Ga18 1 0.59409564 0.78012719 0.95297396 1.0 Ga Ga19 1 0.24349711 0.09921672 0.96465436 1.0 Ga Ga20 1 0.85571761 0.09921672 0.53534564 1.0 Ga Ga21 1 0.85571761 0.09921672 0.96465436 1.0 Ga Ga22 1 0.81396845 0.21987281 0.04702604 1.0 Ga Ga23 1 0.79828484 0.59656767 0.92702064 1.0 Ga Ga24 1 0.34269487 0.68538873 0.46833934 1.0 Ga Ga25 1 0.40590436 0.21987281 0.45297396 1.0 Ga Ga26 1 0.77338707 0.54677614 0.75000000 1.0 Ga Ga27 1 0.25698384 0.93567660 0.25000000 1.0 Ga Ga28 1 0.18603155 0.78012719 0.54702604 1.0 Ga Ga29 1 0.25774139 0.51548279 0.15691916 1.0 Ga Ga30 1 0.75650289 0.90078328 0.03534564 1.0 Ga Ga31 1 0.51632674 0.03265248 0.91039297 1.0 Ga Ga32 1 0.37262721 0.34458843 0.79678685 1.0 Ga Ga33 1 0.65730513 0.31461127 0.96833934 1.0 Ga Ga34 1 0.14428239 0.90078328 0.46465436 1.0 Ga Ga35 1 0.57434994 0.14870088 0.82842598 1.0 Ga Ga36 1 0.75650289 0.90078328 0.46465436 1.0 Ga Ga37 1 0.14428239 0.90078328 0.03534564 1.0 Ga Ga38 1 0.42565006 0.85129912 0.17157402 1.0 Ga Ga39 1 0.92627147 0.85254294 0.75000000 1.0 Ga Ga40 1 0.74301616 0.06432340 0.75000000 1.0 Ga Ga41 1 0.65730513 0.31461127 0.53166066 1.0 Ga Ga42 1 0.37262721 0.34458843 0.70321315 1.0 Ga Ga43 1 0.02803877 0.65541157 0.29678685 1.0 Ga Ga44 1 0.67869275 0.93567660 0.25000000 1.0 Ga Ga45 1 0.51632674 0.03265248 0.58960703 1.0 Ga Ga46 1 0.22661293 0.45322386 0.25000000 1.0 Ga Ga47 1 0.20171516 0.40343233 0.42702064 1.0 Ga Ga48 1 0.62737279 0.65541157 0.20321315 1.0 Ga Ga49 1 0.18603155 0.78012719 0.95297396 1.0 Ga Ga50 1 0.48367326 0.96734752 0.41039297 1.0 Ga Ga51 1 0.59409564 0.78012719 0.54702604 1.0 Ga Ga52 1 0.32130725 0.06432340 0.75000000 1.0 Ga Ga53 1 0.57434994 0.14870088 0.67157402 1.0 Ga Ga54 1 0.79828484 0.59656767 0.57297936 1.0 Ga Ga55 1 0.48367326 0.96734752 0.08960703 1.0 Ga Ga56 1 0.25774139 0.51548279 0.34308084 1.0 Ga Ga57 1 0.81396845 0.21987281 0.45297396 1.0 Ga Ga58 1 0.02803877 0.65541157 0.20321315 1.0 Ga Ga59 1 0.07372853 0.14745706 0.25000000 1.0 Ga Ga60 1 0.42565006 0.85129912 0.32842598 1.0 Ga Ga61 1 0.74225861 0.48451721 0.65691916 1.0 Ga Ga62 1 0.97196123 0.34458843 0.70321315 1.0 Ga Ga63 1 0.62737279 0.65541157 0.29678685 1.0