64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-121.99565337633649 stress="190.85979451131766 35.3331014197139 134.07274198452063 35.3331014197139 -90.79403666822607 40.03051207400438 134.07274198452063 40.03051207400438 26.970790431506444" pbc="F F F" C 0.24315639 0.25843578 0.63305582 2.65889247 0.83770373 0.74513523 C 1.78627534 0.75190518 1.13794895 -2.71984490 -2.30820251 0.82487965 C 2.06320564 2.52313143 -0.06361920 -0.35019213 -0.17260401 -0.91128063 C 3.45458957 4.14450871 0.71847272 0.28431198 0.65647496 -1.07282412 C 2.20693956 0.10611283 2.56239397 52.21202319 8.84859201 19.65016338 C 4.29680508 0.43859123 3.40640986 -52.49929133 -9.11380418 -21.45438659 C -0.15735302 2.49054347 3.02257956 -0.98252276 0.00628065 -1.02548589 C 1.55604684 4.07636534 3.99475015 -10.65433608 26.14209967 -14.83793579 C 5.44932342 0.60142686 -0.24329202 -0.85171334 -0.88812107 -0.54558534 C 6.59993901 1.62196069 1.50500385 0.16329576 0.22600762 0.46789613 C 7.08950303 2.26040784 -0.26093396 0.15040550 0.27629622 -1.24947830 C 8.40246533 3.48587157 0.42231838 0.96765945 0.45510341 -0.18180925 C 7.57570835 -0.14144238 2.51185162 -0.08813665 -1.53455408 -0.12398332 C 8.64494096 1.05105641 3.67186016 0.86750698 -0.23534620 -0.02210394 C 4.38960959 2.48919025 2.07779184 -0.75910691 -0.13133466 -0.45468064 C 5.48273864 3.14155071 3.62524182 0.81231197 -0.01931876 0.66392659 C -0.01788604 4.56612752 0.02790792 -0.39697352 -0.25977114 -0.21251453 C 0.75044987 5.99318258 0.76650187 -0.38475451 -0.03731490 0.05837637 C 2.70047592 7.41706692 -0.18662303 2.07888931 2.78756934 2.84421850 C 3.41055920 8.33298660 1.03311963 0.25035490 -3.41550267 -1.86973764 C 2.80356076 5.04298523 2.59785466 -0.54775775 0.67422285 -0.28445857 C 4.56907020 5.79371495 3.29727116 0.56879028 0.44926120 -0.14572581 C 0.55101783 8.04533477 2.68268603 -0.47956751 -0.12466063 -0.65926559 C 1.32593226 8.75634842 4.33224319 -0.24974316 1.54718923 0.33671741 C 5.38619242 5.66097840 -0.29694171 -0.38480811 -0.14007247 -1.27921403 C 6.60365422 5.93458664 1.46651109 3.88010707 -2.17386055 2.79489758 C 7.13700750 7.97130329 0.10350000 76.53775370 21.10445659 52.00366055 C 8.97271432 8.46171569 1.36724050 -76.11960797 -20.29692381 -52.51475740 C 8.01415047 5.22835042 2.39286536 0.80724901 5.00363875 2.81505589 C 8.86488979 5.93489671 3.36435524 -3.49056216 -3.56489026 -4.34586264 C 4.58563925 7.82755393 1.82539468 -2.82692317 1.77486141 -2.03056712 C 6.22322507 8.06949203 3.62500012 4.44584770 0.78499319 2.34903138 C 0.18588975 0.42604545 4.46002761 -0.70909387 -1.15517289 0.00096035 C 1.16102601 1.58802699 5.66158531 -0.02493229 -0.20731786 0.27834036 C 2.00297454 2.99791377 4.62151619 11.89746369 -26.27054873 14.90864771 C 3.75399317 3.98600117 6.57405090 -0.04418442 -0.80476789 0.13199452 C 2.06637370 0.44626641 7.59097952 -0.70893823 -0.79611925 0.17785846 C 3.86980154 1.08366446 8.45957414 -0.21284798 -0.32846245 0.96252546 C 0.15278053 3.10430573 7.57279647 -2.78444237 -1.72302571 -2.40991724 C 1.08679724 3.82754427 8.69910336 1.79295832 1.33423794 3.22084170 C 4.90778115 0.28356067 5.71030970 -2.72594641 -1.93899857 -1.56495106 C 5.99794756 1.03295591 6.59119870 3.47606705 0.78940047 1.06615360 C 8.33501695 2.57669764 4.96144944 -0.24770316 0.64176834 0.15498600 C 8.87333275 3.51129255 6.43155688 0.58444284 -0.31569603 0.13243713 C 7.56912506 0.08820912 6.61990307 -0.66793083 -0.03315954 -0.84633484 C 8.59101494 0.35702502 8.56959982 0.55715959 0.13873054 1.04589490 C 5.55137875 2.36040852 8.24064610 -20.13421085 -25.68460997 -2.63220613 C 6.35380400 3.39002611 8.37263369 20.83197141 26.68854508 3.81677001 C 0.14647164 4.78943560 4.95926540 -1.37252775 -0.16195276 -0.03367772 C 0.88698845 6.61356488 5.86193449 -0.14613755 -0.14362913 0.42208977 C 2.82350393 7.07074874 4.80335328 0.72964248 -0.73188307 -0.50924793 C 3.94612351 8.14012417 6.01950631 -0.09284117 1.14545667 -0.24412131 C 2.36102597 4.94186987 7.87644269 -0.88950301 0.68698139 0.06366604 C 4.23985324 5.79357549 8.78505241 0.26849616 -0.25545876 1.53231374 C -0.37064407 7.80367007 7.32271401 -1.63579686 0.10785128 0.35673702 C 1.53724018 8.69867985 8.00057689 0.98925064 0.58261162 0.50279025 C 4.95603217 4.35983264 4.88508359 0.46965529 -0.65107452 -0.09370565 C 5.95475090 5.96094012 6.45328736 0.08753429 0.17058900 -0.85350299 C 7.55951826 8.19798441 4.21465155 -3.98242376 -0.05124865 -1.54710313 C 8.74662160 8.75079243 7.06030953 0.33993874 0.05453233 -0.17921932 C 7.81078556 5.47523520 7.45004689 0.40942784 0.42745932 0.05808766 C 8.90025676 5.92777150 8.72358967 0.57922354 0.22580150 0.70491446 C 5.17219842 7.29888575 7.61023418 0.51476625 0.85502620 0.58557999 C 6.60231395 8.70201121 8.78754074 -0.04809491 0.24566519 0.45809666