500 Lattice="25.303329020488658 0.0 0.0 0.0 25.303329020488658 0.0 0.0 0.0 25.303329020488658" Properties=species:S:1:pos:R:3:forces:R:3 energy=-16.876273557775118 stress="-3.947516919783452e-05 -3.791609425044e-05 4.942504684060647e-05 -3.791609425044e-05 -0.00011881645981825247 -1.4816319758288499e-06 4.942504684060647e-05 -1.4816319758288499e-06 -0.00010151455208315653" free_energy=-16.876273557775118 pbc="F F F" Ar 0.04042708 0.02438500 0.00232362 0.00666697 0.00689672 0.01122149 Ne 2.49664543 2.53332865 0.01300345 0.00152656 0.00207524 0.01090303 Ne 2.59554541 0.01181826 2.54892865 -0.00021810 0.01106756 0.00148879 Ne 0.03306403 2.58771066 2.51992456 0.01024725 0.00040539 0.00183322 Ne 5.12834556 0.03081915 0.07965977 0.00001910 0.00846338 0.00794402 Ne 7.64179252 2.47902562 0.04676278 -0.00068481 0.00118119 0.00970602 Ne 7.57885123 0.03409377 2.45886529 0.00196069 0.01131855 0.00114948 Ne 4.98032436 2.59333019 2.53617874 0.00075638 0.00066317 0.00212437 Ne 10.13851366 0.00444705 0.03156633 -0.00067980 0.00834845 0.00771358 Ne 12.67834893 2.53146781 0.03442681 0.00010457 0.00088454 0.01035987 Ar 12.60404885 0.00518085 2.54356221 0.06112709 -0.03828204 -0.04748746 Ar 10.14671392 2.49133210 2.52470194 -0.05930132 0.00591922 -0.02658367 Ne 15.17867300 0.02306046 0.02764380 0.00047647 0.00866670 0.00883343 Ne 17.72534259 2.49332919 0.00257692 0.00011406 0.00357741 0.01144585 Ar 17.67499057 0.00068335 2.59039966 -0.05199676 -0.00346880 -0.00918388 Ne 15.25589383 2.54999773 2.53993919 -0.00304753 0.00134749 0.00190059 Ar 20.21739938 0.03572617 0.00166286 -0.02284471 -0.03048080 -0.03793176 Ar 22.78370637 2.50501359 0.04034833 0.03772015 0.02115951 -0.04776025 Ar 22.75582969 0.04371472 2.56844208 0.04844509 -0.03700768 0.02219918 Ar 20.23172326 2.48645313 2.54993874 -0.04049495 0.06583944 0.02411892 Ne 0.03105496 5.06447167 0.01814352 0.00820291 -0.00092249 0.00879048 Ne 2.53108704 7.66816115 0.00426843 0.00180553 -0.00029815 0.01153266 Ne 2.53561004 5.10301799 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0.04889740 -0.04734257 -0.02392835 -0.01004638 Ar 22.74009842 7.54851246 0.02287088 0.01709660 0.03367523 -0.01723887 Ar 22.80826948 5.04754717 2.56870595 0.02877504 -0.01399927 0.01929793 Ne 20.29199455 7.54102645 2.55035725 -0.00451397 0.00222372 0.00215543 Ne 0.04598146 10.14775195 0.03836294 0.00817757 -0.00012723 0.00831076 Ne 2.49702876 12.56846203 0.00052213 0.00090593 -0.00014755 0.01131452 Ne 2.58899499 10.14484417 2.46183169 0.00072449 0.00081392 0.00449831 Ar 0.01224937 12.63848793 2.54522895 -0.00052000 -0.01037297 -0.06123853 Ne 4.96795951 10.19638458 0.02174303 -0.00053704 0.00009613 0.01208559 Ne 7.51808875 12.72001582 0.02815476 0.00031447 0.00039032 0.01098089 Ar 7.54234314 10.12411966 2.52341984 0.02684276 0.01531033 -0.03225655 Ne 5.13457714 12.70027362 2.48626938 -0.00179466 0.00071922 0.00476186 Ne 10.11031389 10.15650784 0.00998551 0.00169394 -0.00074885 0.01187826 Ne 12.63300565 12.61238703 0.04267765 0.00018703 0.00169655 0.01066320 Ar 12.67691713 10.10614875 2.56334874 -0.02319736 0.02550857 0.00279773 Ne 10.10061242 12.65940374 2.52054690 0.00021735 0.00111956 0.00227730 Ne 15.11660445 10.15132900 0.01051827 0.00197080 0.00015486 0.01159122 Ne 17.79157951 12.69424115 0.00692357 0.00001621 -0.00091982 0.01199934 Ar 17.74112420 10.08492297 2.50389514 0.01478905 0.03533985 -0.00716306 Ne 15.18775699 12.68550792 2.50153648 -0.00017531 -0.00295991 0.00280258 Ne 20.23782421 10.12075405 0.01602020 -0.00004169 -0.00194943 0.01041544 Ne 22.75540859 12.58985492 0.03469420 -0.00761120 0.00111343 0.00721789 Ar 22.76052066 10.15592142 2.55085574 -0.01866219 0.02870640 -0.00141558 Ne 20.21893677 12.65166747 2.50548122 -0.00058722 -0.00008362 0.00191962 Ne 0.07668411 15.16999799 0.03804188 0.00781992 0.00082036 0.00899618 Ar 2.55431784 17.72752791 0.00203765 -0.02761585 -0.05954586 -0.02464698 Ne 2.50260278 15.22458716 2.58330669 0.00371726 0.00112786 0.00003577 Ne 0.03621651 17.76632916 2.54067618 0.01186665 -0.00142151 0.00219533 Ne 5.01690858 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22.77960513 15.19790826 2.50352547 -0.01460603 -0.04167348 0.01515741 Ne 20.20640537 17.68394927 2.50934936 -0.00060125 0.00111918 0.00146896 Ar 0.00428360 20.25223879 0.06693437 -0.02517071 0.01541128 -0.00900651 Ne 2.52815595 22.80079724 0.04063203 0.00026589 -0.00962213 0.00723054 Ar 2.56919593 20.27073383 2.51252858 -0.02411760 -0.01406147 0.03987764 Ne 0.02640816 22.71876112 2.59769173 0.00842264 -0.00570784 0.00055750 Ar 5.06286490 20.21253811 0.00113167 0.02508441 0.02629766 -0.06505442 Ne 7.49987281 22.69460473 0.00123003 0.00244929 -0.00693233 0.00738363 Ar 7.56705024 20.19839144 2.52593291 0.01965564 0.04271711 0.02735215 Ar 5.01240498 22.79200841 2.50638513 0.03562183 0.03589342 0.00106210 Ar 10.10159624 20.22709088 0.01042245 -0.01242281 0.02383172 -0.01757883 Ar 12.71865750 22.78880734 0.00310668 -0.01230967 0.01646693 0.01608816 Ne 12.65591454 20.23675390 2.59741821 -0.00093235 -0.00146785 -0.00183247 Ne 10.10328364 22.79648911 2.50974063 0.00030979 -0.01264056 0.00153505 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