64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=64.69760128452762 stress="-0.0018273338191703225 -0.0002870806202349586 -0.0008373980746190319 -0.0002870806202349586 -0.0020375895579071994 -0.00023393846411251377 -0.0008373980746190319 -0.00023393846411251377 -0.0015401065915586624" free_energy=64.69760128452762 pbc="F F F" Si 35.22086729 34.98310996 34.77096654 -3.28355921 -2.68525198 -2.29258893 Si 36.59933616 35.93572417 35.98055861 -14.00536503 -37.42051798 24.94898969 Si 37.14715992 37.22516294 35.23402360 -0.84569965 14.57369182 -43.52571945 Si 37.93229823 38.31172061 36.19084223 18.42555556 23.60843193 18.74026994 Si 37.29465675 35.14771729 38.20399864 -2.30479584 0.29175716 -0.42764226 Si 39.35802973 36.07349581 38.45018589 -1.39008810 -33.09613642 12.40462102 Si 34.76884260 38.20444678 38.02575960 -3.01022594 -0.99125641 -2.36025629 Si 36.55604684 39.07636534 38.99475015 -35.15807384 95.17427919 -62.94353838 Si 40.23975440 35.55577733 35.25284888 -2.60421989 -1.10328871 -3.65382738 Si 41.57116719 36.00454661 36.78983070 1.26640131 2.58477958 2.69076623 Si 42.51432400 36.93324962 34.69615509 0.16603437 1.24196653 1.55303139 Si 43.42712388 38.91385061 36.22088890 8.12641928 -12.24270377 -10.94142906 Si 42.73578848 35.29825864 38.47892573 -9.98786211 -13.99833533 -4.44855119 Si 43.94092265 36.56606735 38.98245906 21.36687447 3.20200834 -6.71901491 Si 39.39630707 37.63789511 37.84544830 -13.02672544 25.35472611 -17.94214515 Si 40.96332197 38.14653243 38.64826398 17.10918019 7.72419440 7.06514881 Si 34.72941635 39.65017747 35.17843495 -3.81508076 -6.33960489 -2.99206786 Si 35.67994952 41.20201413 35.91957267 -6.93890230 -3.97182970 12.77671464 Si 36.83832478 42.32454839 35.07964709 12.11283130 10.93058030 -8.56720131 Si 38.61643991 43.32327578 36.40123177 -65.47397237 39.46485401 -43.98116398 Si 37.95366604 39.88968876 37.71888199 -22.36662295 -13.89959624 -16.74798343 Si 39.18297782 40.79320854 38.39174556 25.26041210 18.59742595 15.03619333 Si 35.30302897 42.85953330 37.63905551 -9.01415581 -5.20440885 -13.90919604 Si 36.24427906 43.37779151 39.11824152 3.83384421 9.81003263 8.52271629 Si 40.63153922 40.45221119 35.16239131 -12.62337184 -8.03088406 -17.35651481 Si 41.60365422 41.12475624 36.46651109 -8.55373105 31.75245906 -2.34620086 Si 41.65903605 43.33357737 34.74691298 1.04315634 -1.42158766 1.86482296 Si 43.62645804 43.01529842 36.36792425 -1.71780419 -1.73046166 0.71883958 Si 42.58087455 40.09122498 37.35935114 7.04810330 -16.08986831 23.84768389 Si 43.73510397 41.07781524 38.65337001 3.87295332 6.39802778 3.82937646 Si 39.66448343 42.68403127 37.11226018 65.25406396 -40.44488959 42.85886990 Si 40.97555741 43.31914392 38.89352680 -27.41533762 11.46238838 -14.61941339 Si 34.79982066 35.07367197 39.04841791 2.19370742 0.74639565 0.81846347 Si 36.13897766 36.35282927 40.68258771 -2.32700922 -4.80037793 2.63429455 Si 37.00297454 37.99791377 39.62151619 37.85500796 -104.52908892 48.31898645 Si 38.27194644 38.51894432 40.89808557 9.05424737 2.59156663 12.84355622 Si 37.27802779 34.89707798 42.78076306 -1.10832573 1.16846663 -2.10271434 Si 39.08450338 35.75571598 43.82529712 -5.56452672 -6.04279381 5.48050169 Si 35.41072149 38.40165215 42.83367529 -130.75671442 -83.93369604 -115.27280409 Si 36.22422232 38.91950201 43.54655608 106.43151181 61.48907709 128.84495981 Si 39.86303500 35.18273192 40.63123922 -7.78327964 -2.84783257 -5.27022336 Si 41.48837336 36.00831489 41.43404765 -26.19865350 54.80782731 -27.01906627 Si 42.84911873 37.42573337 40.17872156 -35.51157979 -25.40768487 -16.81234713 Si 43.60556472 38.49425818 41.03735392 27.93374001 31.67738338 25.86954827 Si 42.20384740 34.85081933 42.03810700 32.18405607 -55.17928784 24.81526725 Si 43.40483238 35.47028553 43.56460464 3.53438502 1.15659948 4.38080841 Si 40.24150778 37.00409575 42.88390785 2.96962143 8.06185130 -2.89416313 Si 40.95198476 39.00576363 43.68573388 4.58811959 -2.98049948 -0.91859578 Si 35.14758552 39.78870018 40.00686066 -12.01821187 8.33648686 9.12739217 Si 35.80085817 42.04657078 40.80638853 2.78750716 -11.96275998 -9.68088916 Si 37.82350393 42.21827495 39.80335328 -6.03411448 -19.40933465 -15.91488098 Si 38.63834321 43.28337470 40.87827378 15.92986814 16.63470361 17.45090276 Si 37.36102597 39.94186987 42.87644269 25.91271124 21.47390889 -14.88999477 Si 39.69225143 40.63183112 43.95736664 -4.51806794 3.71264891 -0.43248497 Si 35.04200871 42.98730845 42.19801729 -19.40327326 -0.24176960 0.53724442 Si 36.22062300 43.77377768 43.28993392 12.78967124 8.62849991 11.99341755 Si 39.81899047 40.03247668 40.85421832 -24.37783257 -28.83940509 -10.38467812 Si 40.89974943 41.22892384 41.12165250 56.32784175 -22.15471362 -51.23859571 Si 42.34497277 42.80178516 39.71375535 28.43579556 -11.37607119 16.70299729 Si 43.91609134 43.82709812 41.74953070 -3.90900758 -0.52233715 1.21200120 Si 42.76961237 40.00036892 42.15602423 -4.54433332 2.99756080 2.78581190 Si 43.46907250 41.19521481 43.88955235 -0.09060945 1.74309115 0.59391776 Si 40.39757659 42.11536967 42.13716159 -29.43958224 53.50266235 60.31190084 Si 41.75211220 43.77016552 43.57819544 3.30709416 -2.00205880 -2.97412363