64 Lattice="5.0 0.0 0.0 0.0 5.0 0.0 0.0 0.0 5.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=4.055899724886886 stress="-4.644208513849836 -0.6022089031877653 -0.28236817927035274 -0.6022089031877653 -4.718805737631692 -0.28599140920624455 -0.28236817927035274 -0.28599140920624455 -4.618849012474939" pbc="F F F" Ar -0.24099151 -0.01522905 0.64594072 -0.06858957 -0.02710938 -0.03247292 Ar 0.97433616 0.31072417 0.15341058 0.04617070 -0.31189958 -0.07456287 Ar 0.89715992 0.97516294 0.23402360 -0.17677005 -0.11517484 -0.08674640 Ar 1.09209764 1.45839996 0.33890753 0.12217570 0.38443068 0.01265364 Ar 0.57506261 -0.06841967 1.81459121 0.29694697 -0.12778342 -0.19803954 Ar 1.98340215 0.35556936 2.01717898 -0.06722754 0.03865449 -0.13952541 Ar -0.35328968 2.12091231 1.55973961 -0.10592813 -0.04271412 -0.10494381 Ar 0.93104684 2.20136534 2.42881357 0.05756997 0.24551784 0.09602523 Ar 2.87367246 0.29377055 -0.24329202 -0.02637194 -0.04129335 -0.02414743 Ar 3.59707129 0.94494755 1.09602384 -0.07943524 0.00878997 -0.04583762 Ar 3.81413860 1.17957765 -0.13579737 -0.11057617 -0.12880113 -0.10587630 Ar 4.30482227 1.68876137 0.03279104 0.17768324 0.14614431 0.00129961 Ar 4.06964364 0.29825864 1.73568119 -0.04562775 -0.21729687 0.00830352 Ar 4.56592265 0.94123313 1.73282559 0.18723294 0.10991761 -0.01661010 Ar 1.94331377 1.42682157 1.19339995 0.07651491 -0.18329938 -0.07999394 Ar 2.80163375 2.07376753 1.89769330 0.13226715 -0.08941825 0.07607507 Ar -0.24668824 2.43068720 0.10549878 -0.15159933 -0.11089109 -0.05405534 Ar 0.28851848 3.04060782 0.56604253 0.00296267 0.07538126 0.12212876 Ar 0.48911896 3.01494309 -0.30553105 0.08196751 0.05397635 -0.18550963 Ar 1.74143991 3.94827578 0.77623177 -0.22019156 -0.17518466 -0.11017173 Ar 1.70366604 2.14871261 1.46888199 -0.14805948 0.04682761 -0.02056881 Ar 2.30797782 2.66820854 1.34869803 0.06098551 0.15687164 -0.11422339 Ar 0.74335092 3.83544699 1.38905551 -0.06866346 0.05255794 -0.02560140 Ar 0.63484596 4.28849090 2.59677037 -0.01198892 0.18141844 -0.02072908 Ar 2.80233726 3.29641666 -0.29694171 -0.02975348 -0.02241907 -0.07579259 Ar 3.47865422 2.99975624 0.84151109 -0.15229783 0.20032215 -0.15677773 Ar 3.64884849 4.22130329 0.10350000 -0.03523142 0.06918114 -0.05188460 Ar 4.59771432 4.07076325 0.50369381 0.10069877 0.01935757 0.01454739 Ar 3.83087455 2.59122498 1.10935114 0.16095103 -0.22078912 0.08756814 Ar 4.60269358 2.92740743 1.67032507 0.11826499 0.02801992 0.06878531 Ar 2.16448343 4.33607962 0.86226018 0.23203455 0.27798218 0.01572954 Ar 2.85055741 3.94414392 2.01852680 0.04205325 0.07351564 -0.15044032 Ar 0.05615299 0.04331559 2.07551571 -0.36381501 -0.04340344 -0.02268151 Ar 0.25849640 0.34362974 2.71766193 -0.02001287 0.08909909 0.21840479 Ar 0.75297454 1.74791377 2.09762079 -0.11041389 -0.30164036 -0.21565274 Ar 1.36722156 1.64394432 3.22225891 0.04572454 -0.21742828 0.06962176 Ar 0.90036346 -0.03010948 3.61669775 -0.00312310 -0.04511758 0.06352789 Ar 2.20950338 0.13071598 4.20975277 -0.15019020 -0.20344848 0.06979693 Ar -0.00344088 1.71978731 3.30087869 -0.13303882 -0.07604572 0.05293008 Ar 0.59922232 2.04450201 4.17155608 -0.09474828 -0.04940637 0.21622868 Ar 2.35297294 0.00137669 2.58911716 0.02878031 -0.13602992 0.05186159 Ar 2.96625115 0.38331489 3.39791772 -0.06702181 0.12881583 -0.01439764 Ar 4.09911873 0.81582207 2.97319003 0.04037694 -0.10257400 0.02599182 Ar 4.23056472 1.61925818 2.91235392 0.05825801 0.16524634 0.00275381 Ar 3.45384740 -0.14918067 3.28504070 0.15863961 -0.24049996 -0.01811440 Ar 4.29402247 0.54627935 4.34744698 0.04604515 -0.00706130 0.05890701 Ar 2.59980901 0.75409575 4.26919817 0.05467165 0.14978517 0.11974169 Ar 2.81542883 1.85573442 4.42962855 0.01726445 -0.12093468 0.06193390 Ar -0.16713376 2.43847466 2.43496123 -0.14325690 0.05620691 0.04305413 Ar 0.19042886 3.48856488 2.73693449 -0.06393372 -0.02978430 -0.01879862 Ar 1.57350393 3.46827495 2.30335328 -0.07735443 -0.02387711 -0.06389177 Ar 2.22267622 3.90837470 2.75327378 -0.04754217 0.19278277 0.05435131 Ar 1.11102597 2.44186987 3.64847124 0.04897034 0.17809093 0.07448546 Ar 2.72712731 2.66857549 4.41005241 -0.07808524 0.11509377 0.09912024 Ar -0.37064407 3.69708304 3.57271401 -0.08416625 0.03079206 0.09632644 Ar 1.35763315 4.07414658 3.55421857 -0.01664991 0.05539433 0.11766095 Ar 2.00493887 2.24812168 2.86873861 0.11104863 -0.01490290 0.01270156 Ar 2.77474943 3.10392384 2.99665250 -0.04229663 -0.29375755 -0.30941419 Ar 3.59497277 4.05178516 2.63960947 0.14707064 0.08304020 0.00255360 Ar 4.35078504 4.52806885 3.66839087 0.04053181 0.03684494 0.01617324 Ar 3.76989586 2.66411348 3.72088966 0.11155737 -0.06982270 -0.04624357 Ar 3.95786542 3.19498943 4.55458140 0.08325237 0.04467475 0.11217772 Ar 2.89757659 3.36536967 3.38716159 0.12163097 0.24289733 0.39573455 Ar 2.87929392 4.23824906 4.60919638 -0.01634155 0.05217776 0.04455002