32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1140729.1569373542 stress="-61.15044660313749 -7.637323499016829 -4.029637659712788 -7.637323499016829 -52.75207174698486 8.673066388846005 -4.029637659712788 8.673066388846005 -71.87134317333471" free_energy=1140729.1569373542 pbc="F F F" Rb 20.87274688 21.47425497 21.00081156 -54332.86178485 -91261.51098824 -51771.50747991 Rb 22.50570195 22.51010775 20.80828087 82046.12454334 16584.60489755 -64445.74577178 Rb 22.76782341 21.30872463 22.46272946 -84259.80505483 -49869.97280926 49519.95830330 Rb 21.07206628 22.58194822 22.55071157 -188483.34929236 -679631.88406132 674583.66807034 Rb 23.94622424 21.12806433 21.05244040 3682.62335174 -83400.43967592 -98809.95305245 Rb 25.51706204 22.04399606 21.41472876 94197.43063171 108017.34119281 -165803.95964078 Rb 25.67953968 20.76824684 22.60739274 37456.92257408 -220117.48802895 55073.43207217 Rb 24.11051184 22.72143364 22.72711922 -264064.76615925 -244869.90609029 87663.13171162 Rb 20.96479089 23.49319449 21.27959245 -167364.68010198 473299.70252432 -767151.69072536 Rb 22.47268026 25.78882241 21.06433589 4242.43793803 17557.81273420 -25473.24349056 Rb 22.32329297 23.73494633 22.60103208 319313.01680624 295467.98504265 -185327.68307091 Rb 20.98886518 25.06475910 22.26192699 -69531.74386159 129765.75755337 30380.47382379 Rb 24.20724943 24.33747449 20.88590095 -310653.97980982 -120381.06683716 -292356.01544547 Rb 25.37805325 25.53655005 21.30221470 486512.28707282 213792.40902319 -244426.48281927 Rb 25.25266923 23.76339301 22.12539518 433944.24250277 187120.38460792 77719.23007233 Rb 24.13880869 25.52621423 22.39763254 -330328.47280341 50838.50955595 319512.36689692 Rb 21.01696918 20.87541630 23.90708434 -12669.58164567 -17638.34886690 2091.30222712 Rb 22.47756275 22.72755087 24.00559160 76364.01514023 -201917.09991887 187748.14319022 Rb 22.70822594 21.15216187 25.38219378 -293881.78324009 81888.51724571 368423.12351689 Rb 20.86978315 22.40767372 25.64787388 -11850.42007984 1645.57074813 13999.15564840 Rb 23.70298361 20.71830528 24.15282877 288004.09821425 -150240.89070707 -332783.82019968 Rb 25.46016590 21.99406816 23.95462237 37651.99985653 174301.26590321 -117709.55587103 Rb 25.42374636 21.19684849 25.47880858 7779.95914413 -122024.62398484 230706.88114940 Rb 23.85293565 22.78778164 25.65304073 39967.32183790 -159969.67652775 138960.83678811 Rb 21.07265795 23.90563628 23.97093834 -169595.50190338 81725.19351059 110090.67548102 Rb 22.40788465 25.43889705 23.94964386 673.39744083 87205.07991390 -57521.08074387 Rb 22.79624897 24.24410588 25.34193992 -340664.43595279 -108056.92358532 122886.55699973 Rb 20.81960332 25.72666511 25.48233243 -8529.52343619 5326.17059294 8585.23853715 Rb 24.17658462 23.89334666 24.24119497 -715100.04834103 -147045.08821528 -988362.58112426 Rb 25.64588739 25.53682934 23.83684022 29070.13773269 25632.34178931 -6121.27688326 Rb 25.24501216 24.16037745 25.29512386 969058.41192805 141478.10445591 849837.29489468 Rb 23.98434962 25.46111321 25.51579420 111346.52675175 304778.16900552 70283.12693542