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=218.008636990278 stress="-11.428255072406273 0.4744170608080762 -0.14270184969075211 0.4744170608080762 -11.86471896787992 0.44898185222557163 -0.14270184969075211 0.44898185222557163 -11.177544869646942" free_energy=218.008636990278 pbc="T T T"
In       2.85540510       0.11115480       0.11044915      18.33655384      -8.92875975      -1.89954332 
In       1.70960170       1.31143450       2.71512922     -27.65643132      10.22219945      12.72895135 
In       1.28829595       2.79404596       1.64041416      -5.37347150      12.72661590      -8.89428736 
In       2.77812781       1.72138276       1.32834452      14.69334898     -14.02005560      -1.93512068