4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-9.952807800482052 stress="-30.65634992482553 2.363030245119681 -5.783867460374344 2.363030245119681 -47.962110827231875 -21.24587808063488 -5.783867460374344 -21.24587808063488 -44.77215888271547" pbc="F F F" W -0.14459490 0.11115480 0.11044915 -12.05320595 -26.12002773 -27.99757242 W 1.70960170 1.31143450 -0.16166483 8.16411426 5.55511182 -4.78087421 W 1.28829595 -0.16490224 1.64041416 10.47500278 -7.33302381 11.37726124 W -0.22187219 1.51878885 1.32834452 -6.58591109 27.89793972 21.40118539