32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=3549842.8063675673 pbc="F F F" Th -0.23707696 -0.01307738 0.45265269 90 -10875.71468613 -101161.94234078 -55159.98044184 Th 1.88025967 1.57608841 0.12233248 90 -506557.86311011 145046.89009478 -526164.84118645 Th 1.72722470 0.24027686 1.78789423 90 -652920.44773323 -313216.03771790 -260197.57108240 Th -0.18594784 1.73241573 1.32188451 90 -29918.51046656 73304.41882304 31704.88483728 Th 3.24874231 0.01767642 0.19586800 90 -970019.09030939 -986511.57056679 -2128573.83109631 Th 4.28903690 1.55000414 -0.24076414 90 183726.29785594 75538.64475841 -123599.05679859 Th 4.24266173 -0.06578231 1.42387469 90 1413080.33402186 -484748.74337342 1346495.01059496 Th 3.07126757 1.21079451 1.27856074 90 293567.93734259 1366309.45829541 1054742.81044079 Th -0.22981115 3.50276007 -0.26895897 90 -303383.07592649 -184433.08692497 -119803.66872511 Th 1.26151361 4.39567920 0.13367344 90 334115.29231621 204455.46182806 -27113.21782478 Th 1.66845842 2.83220766 1.72830783 90 -121700.66570315 -344967.49899552 -297856.27120007 Th 0.08254118 4.27856568 1.68277285 90 -140839.98375083 80205.49814142 29458.16268991 Th 3.20720852 3.25424425 -0.28575203 90 -1217420.50230963 -1004354.30712115 -657666.78788306 Th 4.47021472 4.20165921 -0.03221903 90 1242299.26588450 2152495.23527254 -1696316.82714781 Th 4.55788514 3.29027596 1.22325099 90 1378544.86777861 -1973635.46825346 1746737.58926796 Th 3.18302082 4.11881406 1.25149717 90 -1312444.62581189 950883.21204351 514236.68085063 Th -0.02088445 -0.00956768 3.12899409 90 -81739.79864871 -109123.81647515 -97759.06109977 Th 1.62478545 1.27986251 3.53311712 90 -2642888.06555218 1543309.25501730 -2811322.73964228 Th 1.55375793 -0.03926978 4.60233295 90 -656405.90869269 -1330667.81523279 662855.71365554 Th 0.22667452 1.30870379 4.52672969 90 -593892.53591662 168588.58287920 449360.23313999 Th 2.70591493 0.13590441 3.23007395 90 1354277.18803411 -1246979.98779363 -392593.38080262 Th 4.20556653 1.59877204 2.82286782 90 418109.34786529 -216393.38198565 -24274.63908316 Th 4.38197431 0.02132703 4.33337267 90 90367.94141062 -39171.81479364 53850.62892457 Th 2.63061250 1.23055654 4.65380551 90 2670307.96575619 729726.05050321 2714317.17286928 Th -0.03272428 2.92974307 3.17611774 90 -275730.95453478 -122683.08260005 -165382.22738945 Th 1.78977053 4.24631561 2.76056514 90 -71769.93778753 562137.44596087 -101803.65988346 Th 1.42965350 3.20074623 4.22368311 90 512339.05792423 -796794.99483350 307894.47588713 Th 0.26470322 4.33686716 4.51630260 90 -672141.73030979 730959.34225382 247399.79585430 Th 2.90349542 2.70963616 3.20166725 90 22348.81575407 186556.40890714 36537.68939810 Th 4.33226747 4.29232344 3.20460275 90 -4459.82216688 421126.27159784 -462683.91086672 Th 4.67885595 3.16234567 4.44590953 90 148733.45968244 -386640.66346396 455341.74519798 Th 2.73175779 4.49607351 4.31760519 90 203291.46178990 250842.03609579 297339.07854545