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=90.85829918530334 stress="-0.0017199133165779982 -0.0004074524115181355 -0.0008650840226967202 -0.0004074524115181355 -0.0022898041961385823 -0.00019935292755511943 -0.0008650840226967202 -0.00019935292755511943 -0.0014981141650956065" pbc="F F F" Si 35.22086729 34.98310996 34.77096654 -1.14213355 -0.10645927 -1.87518653 Si 36.59933616 35.93572417 35.98055861 -14.52017052 -39.65700455 27.75797658 Si 37.14715992 37.22516294 35.23402360 -3.37054076 12.49078753 -47.77696765 Si 37.93229823 38.31172061 36.19084223 20.66076947 26.62880475 24.51885490 Si 37.29465675 35.14771729 38.20399864 -3.04560476 -0.18506950 0.26857592 Si 39.35802973 36.07349581 38.45018589 0.83918312 -35.96211145 15.71192910 Si 34.76884260 38.20444678 38.02575960 0.74979620 0.91743357 1.62570906 Si 36.55604684 39.07636534 38.99475015 -42.09749752 107.13932553 -66.84546898 Si 40.23975440 35.55577733 35.25284888 -1.29319280 -0.19959709 -3.41752092 Si 41.57116719 36.00454661 36.78983070 0.83623043 2.80282802 1.95126999 Si 42.51432400 36.93324962 34.69615509 -0.81260200 0.79774426 2.19413622 Si 43.42712388 38.91385061 36.22088890 8.09651748 -12.90272122 -12.13288061 Si 42.73578848 35.29825864 38.47892573 -11.95685855 -14.25929767 -3.01576151 Si 43.94092265 36.56606735 38.98245906 18.56819791 11.65794658 -0.07288945 Si 39.39630707 37.63789511 37.84544830 -19.55552294 32.39306024 -25.78692566 Si 40.96332197 38.14653243 38.64826398 20.00939885 5.48563382 9.33933370 Si 34.72941635 39.65017747 35.17843495 -4.59489099 -7.24481825 -3.38553276 Si 35.67994952 41.20201413 35.91957267 -8.00527258 -1.82357695 15.12772708 Si 36.83832478 42.32454839 35.07964709 14.19641545 12.66771571 -7.79999580 Si 38.61643991 43.32327578 36.40123177 -73.78808449 43.12626507 -49.91591780 Si 37.95366604 39.88968876 37.71888199 -29.19276426 -21.77174846 -21.50415668 Si 39.18297782 40.79320854 38.39174556 27.86877154 25.22122562 13.09624241 Si 35.30302897 42.83814538 37.63905551 -7.71338986 -13.65832415 -21.53630293 Si 35.90975672 43.68487883 39.11824152 9.41740212 9.37326373 20.10462433 Si 40.72071477 40.01747273 34.94840508 -0.61205968 -1.83973074 -1.62136630 Si 41.60365422 41.12475624 36.46651109 -21.15828539 22.61839539 -16.56518190 Si 42.28604657 42.89974370 35.56283302 -33.84229745 -25.01818802 -14.89562438 Si 43.49474286 43.82398977 36.01065347 35.58798607 27.21424977 13.18768414 Si 42.58087455 40.09122498 37.35935114 -12.09031666 -22.97166760 5.90536628 Si 43.63143730 40.64491662 38.54600882 21.65578725 12.72920379 25.82238083 Si 39.66448343 42.68403127 37.11226018 74.03030750 -45.64761373 52.83815707 Si 40.97555741 43.31914392 38.89352680 -34.11990570 13.40994898 -23.49519947 Si 35.48200711 35.02979695 39.64687243 -33.95762102 -88.05179312 -59.06738148 Si 35.93325827 36.12341543 40.35225234 38.29729045 89.53066830 57.66604408 Si 37.00297454 37.99791377 39.62151619 42.84813319 -112.35896096 66.32205821 Si 38.50089017 38.51894432 41.34725891 -3.98398867 -2.09755658 4.28613961 Si 37.33719750 35.17049102 42.29388522 -1.06066365 0.11348972 -0.07294150 Si 39.08450338 35.75571598 43.99881808 -5.67499404 -9.02160098 7.97427389 Si 35.23710347 37.96978731 42.51668654 -17.01863493 -16.27276655 -17.57342660 Si 36.22422232 38.91950201 43.54655608 -8.77824480 -7.07585636 32.89833441 Si 39.13213130 35.41553907 40.84226646 2.45950198 0.90952008 -1.21822234 Si 41.48837336 36.00831489 41.43404765 -39.12733416 57.39551309 -29.72450874 Si 42.84911873 37.25854751 40.40500065 -30.48431586 -35.61571864 -16.97510354 Si 43.60556472 38.49425818 41.03735392 25.54292362 39.22520994 19.24183582 Si 42.20384740 34.85081933 42.03810700 37.08824928 -58.78882200 32.75212909 Si 43.82898977 36.05759461 43.76534421 -1.30658089 -0.93195244 -1.38486694 Si 39.73333753 37.00409575 42.77385137 6.17089994 8.39647178 -9.76170260 Si 41.16663094 38.82725993 43.36108682 0.05185115 2.29367764 0.59797700 Si 34.97456502 39.89949207 39.94651716 -5.07932298 1.73701399 2.29653547 Si 36.16201767 41.98989951 40.74303982 -6.93856286 -0.99009230 3.23469895 Si 37.82350393 42.21827495 39.80335328 -9.86308815 -17.82005126 -26.15698390 Si 38.63834321 43.28337470 40.87827378 16.11784679 19.62370072 23.32235908 Si 37.36102597 39.94186987 42.87644269 28.98160589 22.94648570 -15.88305593 Si 39.55457252 40.79284007 43.85695185 -0.19811137 -1.30710808 -3.23212991 Si 35.06236183 42.74812411 42.77511221 -2.05525344 -1.63836428 -1.42779267 Si 36.48115325 43.96771709 43.78828861 2.14030648 1.83980725 1.52841918 Si 39.50493887 39.93176006 40.24335814 4.69134085 -1.01340592 1.38002367 Si 40.89974943 41.22892384 41.12165250 35.59958217 -57.00040731 -65.23997693 Si 42.34497277 42.80178516 39.71375535 33.68993740 -15.74617719 21.47390425 Si 43.54610002 43.89496231 41.59964402 -1.18562999 -0.96551456 -1.75333464 Si 42.83394746 40.70480081 42.92669675 -86.79441826 -54.91495929 -68.29496723 Si 43.77099171 41.28111300 43.66957874 87.34910388 53.71329811 69.31164364 Si 40.39757659 42.11536967 42.13716159 -37.14437904 60.66130469 65.90520030 Si 40.99934153 43.70821989 43.60820831 0.01719810 -0.20095690 -0.23226992