16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=712.6880164082953 stress="-0.05415156559626048 -0.0008562576841186526 -0.004169546264042589 -0.0008562576841186526 -0.03663185482031037 0.019974878318623084 -0.004169546264042589 0.019974878318623084 -0.04759252060443324" pbc="F F F" Cf 21.14311998 20.94447047 21.06595608 -79.45783930 -80.27711166 -124.33928728 Cf 22.59061514 22.26700044 22.50317142 541.67271353 402.26610280 -337.73843467 Cf 24.04873798 20.96707166 20.85421827 -7.98367977 -88.61169560 -106.20482263 Cf 25.35631704 22.29665216 22.48435561 288.95858232 207.20226366 -217.39277425 Cf 20.95377608 24.08212519 20.85890825 -86.42050858 -46.72543668 -74.89974028 Cf 22.32915655 25.30139220 22.49582919 122.85475358 171.53154937 -8.80447553 Cf 23.67869118 23.93508687 20.76029070 54.30062683 -0.53143024 -71.30613054 Cf 25.31561117 25.19503298 22.76155048 103.83623952 123.95459224 -127.14056833 Cf 20.95810644 21.45237933 23.59967474 -615.51469274 -329.63106971 431.69252495 Cf 22.28345544 22.86986784 25.51285066 21.00528079 -156.05834459 214.08363666 Cf 24.18461419 21.10799854 23.99422367 -164.08646876 -326.71718472 259.84850348 Cf 25.45562505 22.75636467 25.40066415 1045.55251332 -742.59966253 934.49937563 Cf 20.94744668 24.11169208 24.02696922 -228.42529459 45.88712990 -16.66605120 Cf 22.70196515 25.61001315 25.60149346 -26.74293124 45.33022328 25.75663423 Cf 24.14781232 23.78210087 24.24858579 -1019.26742002 727.42093234 -820.49120825 Cf 25.41762923 25.64662795 25.52930314 49.71812510 47.55914214 39.10281802