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=2133.8642300533056 stress="-355.53904754356734 116.5915603363783 -107.70092041897308 116.5915603363783 -299.04540710809556 -54.72456986068243 -107.70092041897308 -54.72456986068243 -304.749203212946" free_energy=2133.8642300533056 pbc="T T T"
Kr      -0.14459490       0.11115480      -0.01275680    3571.67953621   -3893.31289325    -241.94745088
Kr       1.70960170       1.31143450       0.04092907   -6116.39642183    3660.23525866   -2362.35417401
Kr       1.35333724       0.05786860       1.64041416    -370.96742618    -726.48056485    -655.77314051
Kr      -0.22187219       1.51878885       1.32834452    2915.68431180     959.55819944    3260.07476540