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=55.50535561935114 stress="-0.0014028878646890049 -0.00010243698095881379 -0.00043234120120592696 -0.00010243698095881379 -0.0013480194825385055 -5.341725552353512e-05 -0.00043234120120592696 -5.341725552353512e-05 -0.001245687727830139" pbc="F F F" Si 35.22086729 34.98310996 34.77096654 -4.94408893 -4.34186218 -2.84900616 Si 36.59933616 35.93572417 35.98055861 -7.48872705 -20.70717434 13.08013156 Si 37.14715992 37.22516294 35.23402360 -1.23573599 8.28091102 -22.49593411 Si 37.93229823 38.31172061 36.19084223 11.48577932 12.80199878 2.32558411 Si 37.29465675 35.14771729 38.20399864 -0.85607307 -0.91764379 -1.76934311 Si 39.35802973 36.07349581 38.45018589 -2.56504064 -4.73459832 4.00812964 Si 34.76884260 38.20444678 38.02575960 -8.30201175 -4.17149366 -8.00543031 Si 36.55604684 39.07636534 38.99475015 -23.49050924 44.67226550 -22.88842689 Si 40.23975440 35.55577733 35.25284888 -3.30223056 -3.40863204 -4.27938782 Si 41.57116719 36.00454661 36.78983070 -0.69486416 3.34100579 -3.58459081 Si 42.51432400 36.93324962 34.69615509 2.01153619 1.92095779 -0.70093382 Si 43.42712388 38.91385061 36.22088890 7.67834860 -10.66750637 -7.35188910 Si 42.73578848 35.29825864 37.98568119 5.17613845 -5.23360625 4.93849253 Si 43.94092265 36.79747090 39.26025248 10.29872773 -8.75356562 -12.53961785 Si 39.61890133 37.67682157 37.20485326 6.82116470 0.92764302 0.90154214 Si 40.92663375 38.41370018 39.17474164 5.01076587 -0.33851391 -2.09195910 Si 34.78999998 39.65336482 34.98106946 -1.51151756 -2.00529488 -1.10218561 Si 36.12186196 40.57149940 36.31379331 -0.85032723 6.48763078 -1.28893139 Si 36.76963915 42.55691150 34.78333901 0.43784334 -0.68102618 1.37021281 Si 38.61643991 43.32327578 36.40123177 -27.90144473 17.97565713 -18.90074731 Si 37.95366604 39.69696332 37.71888199 -2.22780614 8.59066990 -8.31765816 Si 39.18297782 40.79320854 38.77692370 -0.13868150 6.71794795 -3.27446164 Si 35.30302897 42.85953330 37.63905551 -4.55921576 -3.66610429 -9.06378050 Si 36.24427906 43.37779151 39.11824152 -8.38308224 12.06698972 -3.94653715 Si 40.63153922 40.45221119 35.16239131 -9.01620672 -5.27191425 -12.67815269 Si 41.60365422 41.12475624 36.46651109 -8.89701864 17.14289113 -3.22492263 Si 41.65903605 43.33357737 34.74691298 0.39263092 1.30116759 -0.56885238 Si 43.62645804 43.01529842 36.36792425 0.56004428 0.89038053 -0.26204505 Si 42.58087455 40.09122498 37.35935114 3.34074640 -10.33388163 15.72564235 Si 43.73510397 41.07781524 38.65337001 5.63201672 4.27357493 6.44522714 Si 39.66448343 42.68403127 37.11226018 27.27793096 -17.46999337 17.67601455 Si 40.97555741 43.31914392 38.89352680 -10.54421482 9.59073212 -5.85382514 Si 34.79982066 35.07367197 39.04841791 -0.08418832 0.70670363 -0.09253455 Si 36.13897766 36.35282927 40.68258771 -5.30537010 -6.73783116 5.05572039 Si 37.00297454 37.99791377 39.62151619 22.17609045 -53.68189854 26.02961596 Si 38.27194644 38.06977099 41.34725891 4.60541123 1.63737399 9.01502148 Si 37.27802779 34.89707798 42.78076306 -4.11993915 -1.38249591 -2.16213099 Si 39.08450338 35.75571598 43.58475277 -11.35823903 -21.98796627 16.10803563 Si 34.99655912 37.96978731 42.51668654 -7.58120258 -5.77130306 -6.62666884 Si 36.22422232 38.91950201 43.54655608 -5.66215730 -5.06398945 13.14666868 Si 39.77228412 35.41553907 40.84226646 -9.76829605 -4.83807283 -10.25541941 Si 41.48837336 36.00831489 41.43404765 -6.21974077 22.74324997 -9.62027145 Si 42.84911873 37.57553626 40.41930713 -37.48446106 -28.22414419 -17.40209506 Si 43.60556472 38.49425818 41.03735392 30.78686023 40.97902103 29.38704793 Si 42.20384740 34.85081933 42.03810700 19.15780551 -24.68171521 15.05921868 Si 43.82898977 36.05759461 43.76534421 -0.43430459 -0.56240248 -0.39139207 Si 39.73333753 37.00409575 43.00005349 8.34351143 22.25977172 -8.78077165 Si 41.03695434 38.28719268 43.94632733 3.34699292 6.07435196 1.93880243 Si 34.83286624 39.89949207 39.94651716 -7.07310840 7.54513572 6.46388405 Si 36.16201767 41.98989951 40.74303982 -11.87296918 -11.91001611 6.91342083 Si 37.82350393 42.53299423 39.80261787 2.38046268 -14.50395109 -16.59512448 Si 38.63834321 43.28337470 40.87827378 19.82203852 18.15515854 21.90079836 Si 37.36102597 39.94186987 42.87644269 11.09103164 11.16686107 -8.45071180 Si 39.31175267 40.70744521 43.72950645 0.18444676 -1.83288198 3.33494900 Si 35.08175413 42.64192570 42.49502824 -0.00713505 1.67710250 1.92389159 Si 37.05555040 43.97904124 43.25093911 0.22112946 -0.33415696 -0.83149427 Si 39.50493887 39.32584706 40.34642968 8.97627536 2.89583884 5.94443014 Si 40.89974943 41.22892384 41.12165250 17.35818874 -20.88312139 -22.56588191 Si 42.34497277 42.80178516 39.71375535 13.66477049 -5.23753192 6.22879765 Si 43.88267273 43.86430419 41.59585655 -1.27280351 -0.15016698 -0.30521584 Si 42.58408063 40.42044581 42.69024980 -13.24974793 -17.97354771 -18.70748352 Si 43.40319813 41.08609331 43.73545311 15.76114252 13.37873096 19.88361086 Si 40.39757659 42.11536967 42.13716159 -17.09632580 21.55131055 25.14869464 Si 41.10846303 43.86231913 43.49133900 1.49895412 0.70697012 -0.12777057