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:Z:I:1:forces:R:3 energy=-30.74702159334766 pbc="F F F" Ir -0.02015588 -0.09971185 -0.24867593 77 2.84168059 2.26519434 3.50385272 Ir 1.76720059 1.31295637 1.30313226 77 -85.96840356 96.78841353 71.19392562 Ir 3.25889450 -0.07344083 0.20531378 77 39.62639259 -126.09335839 -107.97111492 Ir 4.70214268 1.28988101 1.55359445 77 37.42685965 52.88053186 50.02602700 Ir -0.01390038 2.81544715 -0.28229164 77 5.87578940 -1.60297252 6.54520704 Ir 1.38626504 4.33205029 1.75265227 77 11.23655559 90.71152887 -94.32824521 Ir 3.14665471 3.12787049 -0.25248510 77 -47.00621940 -53.33947541 -55.77754484 Ir 4.29385960 4.41792024 1.38544542 77 55.75668945 58.59028325 47.26290760 Ir 0.28618767 -0.08402801 3.03700813 77 -142.59109299 -130.01635078 -118.29883603 Ir 1.63608552 1.25140001 4.24233408 77 -50.97143705 299.05351009 240.44185553 Ir 2.96622041 -0.25074260 3.29492946 77 159.47969853 -193.78439466 -131.23106483 Ir 4.24235451 1.57063073 4.59340606 77 38.02616975 -3.24357012 27.63038635 Ir -0.12906465 2.91747291 2.91003028 77 -55.94511957 -62.54949136 38.01029815 Ir 1.51977991 4.31742014 4.61235060 77 -40.78056949 35.82280956 48.57932788 Ir 2.94954608 3.12223333 3.10206144 77 31.37246525 -98.01599516 -55.30862943 Ir 4.63543274 4.38788781 4.29472021 77 41.62054125 32.53333691 29.72164740