256 Lattice="10.50003204345703 0.0 0.0 0.0 10.50003204345703 0.0 0.0 0.0 10.50003204345703" Properties=species:S:1:pos:R:3:forces:R:3 energy=-564.2627448853535 stress="-2.2474571994004364 -0.0035767936502330505 -0.011981075992668656 -0.0035767936502330505 -2.2507303407343593 -0.004577005177049464 -0.011981075992668656 -0.004577005177049464 -2.2459090093932415" pbc="F F F" C 0.00586910 0.02078110 0.01604486 11.19838526 9.90429638 9.77242791 C 1.33835723 1.28920471 0.01340487 -6.30933864 -10.68959629 -5.91764645 C 1.29869337 0.01452289 1.30764850 -12.16498039 -8.18414048 -9.81872806 C 0.01484545 1.33208951 1.33648621 -8.04313366 -7.87006584 -6.90565039 C 2.62537497 0.00980542 0.02399900 -0.61734351 2.67455551 1.50870727 C 3.93807260 1.29862572 0.02358252 3.23497323 -10.04383446 -10.63443110 C 3.91810765 0.02289952 1.28683876 1.34537082 -10.38725041 -11.13242006 C 2.64335878 1.29283094 1.33873083 -2.96699501 -6.53793577 -9.74765314 C 5.24884269 0.02238725 0.02119365 -2.68404298 3.82196649 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