16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=6.897724329699963 stress="-1384.703105775107 325.88270810685935 -127.39349337478635 325.88270810685935 -1133.5427101811003 -421.47983050369226 -127.39349337478635 -421.47983050369226 -1047.4342578949072" pbc="F F F" Ir -0.01112755 0.21209889 0.25737656 -75.90039372 -52.63192386 -60.91260123 Ir 1.59960364 1.33405980 1.53351068 152.40300192 -26.72805241 -64.37295978 Ir 3.21396719 -0.18821647 -0.08889070 -17.67423172 -21.95444890 -10.88213330 Ir 4.34107548 1.79237307 0.98803680 133.11286858 -65.88771840 108.61547030 Ir 0.11264608 3.04611006 -0.15627982 -54.84078581 -51.49134622 -53.26865090 Ir 1.43225639 4.31698367 1.36245914 65.31208799 108.62902012 49.15223233 Ir 2.81365336 2.97821246 -0.22208453 -86.73143225 71.51752433 -117.49634028 Ir 4.55317160 4.51597524 1.75164593 7.64464619 13.13051525 -15.47993265 Ir -0.20518735 0.08203475 3.11890393 -94.32106743 -73.65177039 -69.05888394 Ir 1.40722933 1.22817797 4.33560103 87.94900427 49.22765425 138.78446219 Ir 3.22477608 0.22147139 3.00437282 49.79594326 -63.42434067 -19.49881887 Ir 4.53509427 1.61667360 4.65736241 46.46016103 -13.19484651 55.14665511 Ir 0.28170656 2.71503727 2.77437449 -178.93693799 91.98839983 74.36577432 Ir 1.72732122 4.21528851 4.20571389 -241.85794288 228.78830390 190.15947026 Ir 3.14854421 2.94505970 3.16709477 170.85192362 -223.62659121 -232.06912764 Ir 4.26654355 4.61712431 4.60934253 36.73315495 29.30962089 26.81538408