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=114.06492965529455 stress="-0.0026800630135759918 -0.0003720580073244432 -0.0008893605223549377 -0.0003720580073244432 -0.0026746291057503932 -0.00015715094921644383 -0.0008893605223549377 -0.00015715094921644383 -0.002440230187958717" pbc="F F F" Si 35.22086729 34.98310996 34.77096654 -10.71189944 -10.07348009 -5.48483274 Si 36.59933616 35.93572417 35.98055861 -14.25184112 -38.42722564 24.47250666 Si 37.14715992 37.22516294 35.23402360 -5.85223398 4.76258212 -41.14601218 Si 37.93229823 38.31172061 35.96390753 33.39480324 38.04107838 10.74613861 Si 37.52159146 35.14771729 38.20399864 -9.01000656 -8.18825997 -16.47024043 Si 39.35802973 36.07349581 38.45018589 -10.64080661 -1.92377213 5.11192662 Si 34.76884260 38.20444678 37.80973961 -15.88427016 -8.26699135 -17.18435939 Si 36.55604684 39.07636534 38.99475015 -39.08388410 65.96418714 -35.57185894 Si 40.66534341 35.08420154 35.01871475 -3.81633942 -5.95827591 -3.23229474 Si 41.20935311 36.04524550 37.00114475 -4.61792946 0.20025966 -21.28454177 Si 42.53536678 37.19733876 35.14902948 -5.11451579 -8.18553127 -7.01873252 Si 43.67982227 38.51394676 35.37103202 10.10205493 14.23056711 5.09941957 Si 42.34890840 35.29825864 37.98568119 15.16150112 -20.14358952 10.70357917 Si 43.94092265 36.06325021 38.83036396 9.40710525 4.29987793 3.70398128 Si 40.07210940 37.67682157 37.19070156 1.53412436 13.11159383 -0.37208507 Si 40.92663375 38.80271588 39.12622215 17.81741773 -13.00951316 -8.33789866 Si 34.66945659 40.45270357 35.36733977 -18.91003875 -7.17118991 -13.50677883 Si 36.12980493 40.64223427 36.20193068 16.63159919 11.39001887 4.55593765 Si 37.63749534 42.27236655 34.76740513 -6.86796823 -4.95810283 -6.77583621 Si 38.61643991 43.32327578 36.40123177 -50.43015057 33.57748362 -33.17114593 Si 37.95366604 39.42388092 37.71888199 -1.86765841 14.05429930 -21.67611811 Si 39.18297782 40.79320854 38.71297874 -15.03154056 14.42071765 -25.05213526 Si 34.98481081 42.44102317 37.63905551 -3.28561007 -0.07965367 0.23338389 Si 35.99862678 43.66349090 38.92551608 -0.97669938 6.87324730 -1.74260927 Si 40.77137056 40.30010582 34.72444622 -8.12435082 -9.03810607 -10.20798761 Si 41.60365422 41.12475624 36.46651109 -22.34353621 9.80749696 -20.52339938 Si 42.47152985 42.68560390 35.34884679 1.07904549 7.96849712 -9.65565690 Si 43.90115472 43.92104870 35.88926905 5.93986729 4.09677127 3.60256746 Si 42.58087455 40.09122498 37.35935114 10.60563535 -31.85246158 10.55394406 Si 43.62110655 41.43106942 38.19906879 21.21502479 6.39611823 13.11410743 Si 39.66448343 42.68403127 37.11226018 44.79416079 -33.66445969 28.67552402 Si 40.97555741 43.31914392 38.44710954 8.87643642 21.51240202 13.21717144 Si 35.05683674 35.46916971 39.29623789 -11.18547075 -7.74286493 -8.18908180 Si 36.17607196 36.20110399 40.58632960 -10.57549886 2.97544799 11.28600346 Si 37.00297454 37.99791377 39.62151619 45.16746214 -85.76561380 55.48808485 Si 38.58185949 38.02853473 41.34725891 4.48996119 11.10878888 3.36991524 Si 37.02681434 35.22966073 42.20662353 -0.12677482 -6.25227416 4.76662638 Si 39.08450338 35.75571598 43.58475277 -21.91709633 -39.19541393 22.41662371 Si 34.99655912 37.96978731 42.51668654 -19.20524574 -11.48933497 -15.51561458 Si 36.22422232 38.63994533 43.54655608 5.16401485 -2.11398655 19.71905889 Si 39.08256643 35.20197720 40.33758909 11.26823751 -6.63052140 11.81800697 Si 41.48837336 36.00831489 41.43404765 -26.54985471 32.18356242 -24.00655836 Si 42.84911873 37.67261282 40.32855624 -50.96578020 -52.39806653 -47.68875542 Si 43.60556472 38.49425818 41.03735392 53.40445717 57.35675494 49.95758235 Si 42.20384740 34.85081933 42.03810700 22.01253570 -36.52858159 18.05264538 Si 43.24802608 36.25091938 43.76534421 3.29248923 2.24825139 6.45186229 Si 39.73333753 37.00409575 43.00005349 18.05589473 30.24513703 -17.58229877 Si 41.03695434 38.28719268 43.94632733 7.48179031 9.15488396 4.26067369 Si 34.83286624 39.78943560 39.93496123 -18.29053281 16.61476444 14.85752257 Si 35.99704493 41.62512081 41.13696370 -1.77519518 -6.96449003 3.32445796 Si 37.82350393 42.59460959 39.68445861 -16.02693457 -10.40444449 -18.71959539 Si 38.63834321 43.28337470 40.87827378 14.17649549 22.88570608 23.01467401 Si 37.36102597 39.94186987 42.87644269 13.11664061 14.59142314 -7.11307309 Si 39.55457252 40.79284007 43.85695185 -5.81261098 -4.63636436 8.75823061 Si 35.06236183 42.74812411 42.77511221 -3.83269214 -0.42703786 -0.00388593 Si 36.48115325 43.96771709 43.78828861 2.30013366 1.86198620 1.50467239 Si 39.50493887 39.93176006 40.24335814 9.55775187 -14.60436009 21.12672757 Si 40.89974943 41.22892384 41.12165250 39.08827801 -23.90929879 -30.80059999 Si 42.34497277 42.37951054 39.69213017 7.50925197 4.27368414 2.13332171 Si 43.88267273 43.86430419 41.59585655 -2.22055604 -1.26603420 -1.35272317 Si 42.51989586 40.42044581 42.50471806 -0.58809538 -24.71371335 -14.05533879 Si 43.40319813 41.08609331 43.73545311 13.01318154 11.15405317 17.82056358 Si 40.39757659 42.11536967 42.13716159 -32.79403678 46.80447570 49.63682084 Si 41.10846303 43.86231913 43.49133900 3.03030296 1.81689582 -0.11221307