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:Z:I:1:forces:R:3 energy=586397.9642328953 pbc="T T T"
Ir       0.01424936       0.02155095      -0.26411297       77 -1160614.56706284 -426361.80302017 -1356732.32501247 
Ir       0.92803821       0.98430613      -0.09636138       77  652854.18232330 2279232.82280612 -1822327.68891684 
Ir       0.74497285       0.16061096       0.62745377       77 1645059.05279938 -2485095.60540723 2698819.42903538 
Ir      -0.25413097       0.68962473       0.96533008       77 -1137298.66805985  632224.58562128  480240.58489392