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=9048.595306269332 stress="-1598.8712009804995 550.4727485000386 -420.3963414858496 550.4727485000386 -1164.4545884054653 -148.8325725777256 -420.3963414858496 -148.8325725777256 -1497.389905678214" pbc="F F T"
Ir       0.27180537       0.21051108       0.17572278  -16406.85294789  -10722.85195012  -19287.59617758 
Ir       1.38248015       1.56963889       0.08442047    5581.69290892    7040.02569072   -1071.87374323 
Ir       1.24253218       0.18255526       1.46716943   32517.31989033  -17841.41324105   14438.98059029 
Ir       0.02265347       1.20349427       1.58715875  -21692.15985136   21524.23950046    5920.48933052