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=270.7122628162788 stress="-1475.7801779670763 -206.70901729103468 -444.67960191034115 -206.70901729103468 -1384.4795425401567 -362.84026312623604 -444.67960191034115 -362.84026312623604 -1533.3661472483072" pbc="F F F"
Ir       0.17451162       0.26820347       0.03357463    -796.14130841    -685.20658222    -840.98679387 
Ir       1.66888338       1.76985796      -0.22269054     398.88113698     390.71537792    -177.10954222 
Ir       1.68369815       0.02660129       1.44968153     571.68846201    -217.03650903     503.11757674 
Ir       0.07751506       1.72525756       1.53948308    -174.42829057     511.52771333     514.97875934