32 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=38.9256485952 stress="0.007834635955451924 0.013284697495723799 0.01660839928250115 0.013284697495723799 0.02733390293597856 -0.0020368240477197756 0.01660839928250115 -0.0020368240477197756 -0.004292069649505489" pbc="F F F" Ti -0.14375968 0.24624097 0.14302402 0.08279859 0.02111158 0.58786932 Ti 1.35498893 1.61042859 0.20947124 -0.70242300 -0.61440614 0.46523444 Ti 1.35512851 0.05280714 1.41333883 -0.70535260 0.86891890 -1.02099685 Ti -0.15344509 1.37241235 1.32230844 0.93882517 -0.68676641 -0.35804467 Ti 2.91049160 -0.27713580 -0.06141927 0.65973011 0.72699484 0.67858417 Ti 4.15122568 1.65488783 0.32223879 0.19910252 -0.70231102 -0.09285801 Ti 4.05083842 0.37436437 1.31425730 -0.01674202 0.02909112 -0.80028855 Ti 2.98844065 1.53277713 1.39971974 1.34277305 -0.98204333 -0.70873680 Ti -0.12633864 3.17309405 -0.21780693 0.40636720 0.10506349 0.83738057 Ti 1.71813893 4.26716069 0.19410236 -0.41718745 -0.19221300 -0.50497350 Ti 1.33096497 2.88201197 1.43300593 -1.34699442 1.28589129 -1.54087155 Ti -0.27997518 4.27696427 1.41661558 0.29020702 -0.53375764 -0.58005513 Ti 2.96512192 3.22586561 0.29391194 1.13611067 0.84848195 -0.26827214 Ti 4.22614529 4.52103145 -0.22238644 -0.88328242 -0.23063300 0.40429077 Ti 4.68220204 2.89362841 1.73573857 -0.78658745 0.27767011 -0.64578580 Ti 3.02724172 4.27538150 1.20296332 1.27371505 -0.21488852 -0.99520760 Ti -0.20144009 0.22083292 2.78984966 0.17669687 0.39041170 -0.41656478 Ti 1.48735431 1.42299150 2.90698366 -1.78521259 -0.67588661 1.00980199 Ti 1.68107110 -0.17174679 4.63102478 0.49669702 0.42774598 -0.24475726 Ti 0.39589922 1.76120756 4.66904211 0.09177734 -0.41446164 -0.01731406 Ti 3.25226748 -0.03568003 3.04396501 0.53690635 0.38515695 1.11534604 Ti 4.57236142 1.70379337 3.23854596 -0.64724486 -0.73958656 0.26068212 Ti 4.26922180 -0.21770305 4.51073890 -0.64992723 0.24145639 -0.16981530 Ti 3.18745344 1.52015752 4.23657976 0.86262010 -1.38242392 0.44746893 Ti 0.27711528 2.87871118 2.75213077 -0.63729480 0.34601862 1.28421218 Ti 1.23125112 4.19488764 3.13616082 -1.02519495 -0.02495140 1.29162211 Ti 1.26429260 3.12968218 4.71980528 -0.48899955 1.01019157 -1.05030643 Ti 0.29977655 4.68543805 4.69583843 0.77307000 -0.45772796 -0.02014931 Ti 3.07327937 3.19989723 3.12961200 1.13472008 1.00831018 0.89541137 Ti 4.39627152 4.65720406 2.76564846 -0.09787524 -0.47114303 1.02910582 Ti 4.38507600 3.29768454 4.48273691 -0.20770718 0.42030892 -1.02760045 Ti 2.86065667 4.67089611 4.28645472 -0.00409138 -0.06962342 0.15558836