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=-24.46286794600502 stress="-346.30999877909466 -87.08660784712981 71.15563467701506 -87.08660784712981 -294.10886094895505 17.21709897282949 71.15563467701506 17.21709897282949 -401.2429018898124" pbc="F F F" I -0.03008140 0.15880961 0.18979404 -11.34925818 -8.45772258 -20.21158458 I 1.60554291 1.39470430 1.49782815 -0.03641905 30.95502870 -28.20707215 I 3.00687250 -0.04140686 -0.18622861 -12.57652842 -10.90570646 -14.60592827 I 4.42485285 1.12635345 1.39754009 16.63467351 19.68986086 9.66774670 I -0.20582073 3.13638272 0.16285991 -20.59532629 -18.59746507 -19.27399802 I 1.35039557 4.21467854 1.56914096 37.97070006 87.90712676 -23.94870360 I 2.75451386 3.27614489 -0.05540767 21.46273931 -18.55416590 -26.77723579 I 4.50411062 4.21501450 1.71802747 3.44882733 1.29060913 -0.94930106 I -0.11259950 0.17407997 2.71810551 -19.26629145 -13.16244554 12.87320338 I 1.45066835 1.42142851 4.24189128 -33.36909366 -15.77147946 52.62014924 I 2.81459241 -0.05162357 2.93294070 23.23299903 -39.28481861 9.57772857 I 4.51159992 1.67400942 4.28122541 4.81088288 -6.09753869 2.51451465 I -0.00552281 3.16077088 2.98706226 -56.06518383 -39.49255589 51.55661761 I 1.90304183 4.51452722 4.55852604 -15.81620006 24.90995757 23.48654344 I 2.70206730 2.92309682 3.04217732 60.03211054 4.31793755 -28.32427437 I 4.58342686 4.35738040 4.46804763 1.48136828 1.25337762 0.00159425