16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=429.93494164495525 stress="-2507.5832691535593 -779.3216958379259 -904.2752076763231 -779.3216958379259 -2279.4477355717136 -836.7526967018334 -904.2752076763231 -836.7526967018334 -1966.082346625517" pbc="F F F" Na -0.00189632 -0.18301034 -0.07238666 -82.92183725 -68.54047249 -58.40292729 Na 1.46166281 1.31461778 1.21932072 -216.96686941 114.54494622 340.55982104 Na 2.76093560 -0.18553074 0.11099574 189.51274350 -236.45587463 -186.02056446 Na 4.76510069 1.43252802 1.14171338 92.41057983 -33.81897516 35.64554755 Na 0.10347796 2.88624878 -0.14411660 -65.44388214 60.68096329 -55.00114089 Na 1.69434574 4.61940242 1.75017094 -42.27496643 96.35256541 -78.33253163 Na 2.92860902 2.70615416 0.04303075 47.71115654 136.18070092 -185.83017831 Na 4.55137730 4.35538377 1.12052616 51.55734933 51.46405943 17.65708012 Na -0.05636863 0.09587308 3.14511042 -446.27799518 -360.54954922 -320.71613076 Na 1.38495279 1.25653536 4.26220794 378.52809714 334.73187781 388.39868239 Na 3.12875421 -0.03551434 2.82583482 -108.24354390 -225.94011884 -199.98104660 Na 4.20069651 1.20999040 4.40034999 196.81313055 128.74782013 255.14657438 Na -0.14405077 3.20796155 3.07473509 -105.13031860 -62.52414205 -64.88377755 Na 1.27057050 4.50601392 4.59060767 40.71891370 83.51948429 104.22135263 Na 2.98006738 3.08150566 3.17488524 -102.61367779 -186.23545127 -119.91180052 Na 4.43993920 4.50585379 4.24736983 172.62112010 167.84216615 127.45103990