32 Lattice="12.6640491486 0.0 0.0 0.0 12.6640491486 0.0 0.0 0.0 12.6640491486" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-16.9015266113 pbc="F F F" Ba -0.09241926 0.11428679 0.06183626 56 -0.34199990 -0.31690336 -0.39274432 Ba 3.26220989 3.00887437 0.11423619 56 -0.00662695 0.46977173 -0.65085478 Ba 2.98959225 -0.08878908 3.07173773 56 0.16817827 -0.60384752 0.50985124 Ba -0.01764180 3.18166966 3.02296605 56 -0.61069690 0.27812253 0.14668683 Ba 5.98221094 -0.11683345 0.16710781 56 0.28685920 -0.51181506 -0.45498677 Ba 9.55223794 2.92322848 0.12281208 56 0.42437304 0.17484111 -0.63920134 Ba 9.32139202 0.19398563 3.30799325 56 0.64110720 -0.93035540 -0.34087172 Ba 6.56979900 3.22747300 3.05425725 56 -0.67090161 0.04477188 0.49313289 Ba 0.22535006 6.68411066 -0.00245933 56 -0.44369052 -0.62342011 -0.61325944 Ba 3.22013924 9.49142961 0.21952575 56 0.19863361 0.62288183 -0.73428601 Ba 3.37264095 6.17608715 3.09811360 56 -0.13889454 -0.38340333 0.16698898 Ba 0.00891708 9.40491754 2.97469231 56 -0.47339576 0.56763089 0.46915127 Ba 6.41962876 6.35328298 0.13651755 56 -0.12420039 -0.16988289 -0.92324543 Ba 9.59349819 9.52515004 -0.02387056 56 0.12339508 0.21727861 -0.10377603 Ba 9.31546374 6.34584502 3.13771226 56 0.78461960 0.06168517 0.23207088 Ba 5.93939495 9.34935018 3.17735894 56 0.68065378 0.89243575 0.06102464 Ba -0.17452685 0.10880270 6.43467847 56 -0.46457982 -0.43942818 -0.34328557 Ba 3.11389097 2.98140277 6.07950102 56 0.48931940 0.29388327 0.07431775 Ba 3.03373578 0.00476485 9.34527134 56 0.26222629 -0.55977154 0.32087091 Ba -0.07641284 2.95265018 9.57365275 56 -0.33891218 0.43883801 0.34071882 Ba 6.58617187 -0.08767501 6.25995980 56 -0.59163063 -0.41528496 0.18647151 Ba 9.71452577 2.93761656 6.15289736 56 0.40088459 0.68334354 0.23339929 Ba 9.65108450 0.35085513 9.56756462 56 0.15807430 -0.19714551 0.32680041 Ba 5.96787018 3.12275774 9.68215762 56 0.11020437 0.19365701 0.15836528 Ba 0.35484818 6.34274811 6.08523036 56 -0.66095763 -0.21928333 0.10365704 Ba 3.28701100 9.43541498 6.20696747 56 -0.26231582 0.72524913 0.16079967 Ba 2.98451604 6.38181311 9.54978686 56 0.20167383 -0.41840691 0.36868317 Ba 0.04187014 9.35389471 9.55665711 56 -0.32016144 0.31720206 0.12185372 Ba 6.34339678 6.56585841 6.26170014 56 -0.18544638 -0.86428038 0.05665797 Ba 9.61188365 9.41870381 6.47461373 56 0.32198276 0.49323170 -0.25498171 Ba 9.33027858 6.19582796 9.30416695 56 0.40766025 -0.32639986 0.44847656 Ba 6.19480328 9.28260882 9.56980026 56 -0.02543510 0.50480413 0.47151429