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=10017.50571401997 stress="-1721.5458102727775 26.773468421599688 -648.026096642192 26.773468421599688 -1158.5278316379054 426.02162117648953 -648.026096642192 426.02162117648953 -1798.1138306081891" pbc="T F F" Rf 0.04470885 0.08473037 0.23759071 -16938.49922369 -10165.19259777 -20748.09562493 Rf 1.60642246 1.33972733 0.09871241 1481.06809695 18838.50208905 -17150.13607991 Rf 1.26257508 0.24213323 1.43768607 18764.60293475 -14610.91703063 35223.63187091 Rf 0.09202012 1.75843289 1.69409809 -3307.17180801 5937.60753934 2674.59983393