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=5207.865963000138 stress="-978.2855855255277 -7.748876370738833 -128.76547348320324 -7.748876370738833 -640.2502590323064 -43.97532237155696 -128.76547348320324 -43.97532237155696 -960.1338162766699" pbc="T F T"
Ir       0.21136395       0.20577770       0.09198419   -2325.08561054   -8102.72476224    2088.09638499 
Ir       1.65269723       1.24386160      -0.28328563    5692.90437093    8279.58004851    8003.93160394 
Ir       1.67370830       0.07355475       1.38928683    1720.11310430   -7353.24180574   -3091.69460732 
Ir       0.25808234       1.28147101       1.65591290   -5087.93186470    7176.38651947   -7000.33338160