32 Lattice="63.25199508666992 0.0 0.0 0.0 63.25199508666992 0.0 0.0 0.0 63.25199508666992" Properties=species:S:1:pos:R:3:forces:R:3 energy=-18.887559020251658 stress="-4.772124317848023e-05 1.6080723869786797e-07 -7.980665990668565e-06 1.6080723869786797e-07 -5.5524998040988794e-05 -3.4714307612043484e-06 -7.980665990668565e-06 -3.4714307612043484e-06 -6.712117320260182e-05" pbc="F F F" Cd 31.50550179 31.71862654 31.71803850 0.71279761 -0.01264066 0.09019841 Cd 34.05966545 33.72785945 31.49127685 -0.47064698 0.19216921 0.92655205 Cd 33.73665382 31.48857901 34.00200917 0.14013786 0.23525946 -1.10081540 Cd 31.44110405 33.92231254 33.51136488 0.79390511 0.13596691 0.72691596 Cd 36.01112087 31.59178771 31.79482580 0.26477906 0.36549234 0.55369026 Cd 38.45719809 33.56374309 31.51391597 -0.68524906 0.09174282 0.52419227 Cd 38.22635218 31.81163991 34.03986717 0.80461970 -1.84642812 -2.41437182 Cd 36.29702061 34.04818004 34.00737244 -1.73825386 -0.92121476 -1.17588187 Cd 31.64699022 36.29088247 31.75330842 -0.26099233 -0.74740934 -1.16077447 Cd 34.05996687 38.39638976 31.75349947 -1.12409771 0.98950017 -1.08488425 Cd 33.91706667 36.10878602 33.62785678 -0.79370729 -2.02850542 1.21567265 Cd 31.49166024 38.19434986 33.74230685 -0.13891589 1.14315718 0.44084780 Cd 36.30381901 36.29312651 31.86883814 -0.37160653 -2.09821346 -3.50686787 Cd 38.28717198 38.41505545 31.68355216 0.58883558 0.69216333 -0.33112230 Cd 38.22042390 36.23240797 33.85669735 3.18054180 -0.55812858 0.76237652 Cd 35.98231407 38.25431033 33.89634402 0.42554355 3.09264713 1.58425171 Cd 31.66990511 31.60572706 36.19674658 -0.75948323 -0.02602005 -0.39139152 Cd 33.83287605 33.70038785 35.89228375 0.19441821 1.31102610 0.37671501 Cd 33.75272086 31.49383671 38.16760788 0.88616182 0.50488948 0.33244696 Cd 31.55921750 33.66991482 38.47861290 0.63438767 0.23926235 -0.38414120 Cd 36.37083021 31.80573558 36.25343819 -1.92569941 -0.77418779 1.38483275 Cd 38.61948593 33.65660164 35.96486997 1.39912414 2.31458542 2.06363748 Cd 38.55604466 31.79507023 38.47252477 -0.53379528 0.51540648 -0.31455900 Cd 35.98221882 33.82885398 38.58711778 -0.10971229 0.11567422 -0.93995505 Cd 31.90384476 36.29558325 35.89380438 -0.41474487 -1.22221315 -0.16754131 Cd 34.06182448 38.34037514 36.25225274 0.01481716 1.27537239 -1.36374398 Cd 33.70350112 36.37964884 38.45474702 0.85761030 -2.58866391 0.97944088 Cd 31.73735470 38.25885486 38.22748715 -1.38395342 1.04234373 0.38020389 Cd 36.18443447 36.18960968 36.07367276 -1.00074032 -1.45694812 1.42035473 Cd 38.51753215 38.20282141 36.13368355 0.12046982 0.95715867 -0.53433473 Cd 38.40979810 36.23601283 38.08840086 -0.22733774 -1.16970670 0.68363437 Cd 36.00677590 38.18756898 38.47476042 0.92078683 0.23646266 0.42442106