32
Lattice="7.822208679021243 0.0 0.0 0.0 7.822208679021243 0.0 0.0 0.0 7.822208679021243" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-105.83218012539851 pbc="F F F"
Al       0.00059565      -0.02629577      -0.02303034       13      -0.03170454       0.42725252      -0.05826734 
Al       1.94494094       1.98296323       0.03691268       13      -0.49748942       0.89224620      -0.94885390 
Ti       1.91996785       0.00427409       1.94733981       22       1.00293323      -1.05946335       0.37257859 
Al       0.03619397       2.00496442       1.95386295       13      -0.28417278      -0.06736019      -0.25803844 
Ti       3.88333821      -0.01987000       0.03441682       22      -0.26332313      -0.45674345      -0.30491010 
Al       5.87609008       1.98105106       0.00152984       13       0.58216529       0.46098401      -1.02924137 
Ti       5.85035160      -0.00846654       1.93148436       22       0.42327070      -0.39352305       0.35778710 
Ti       3.91906229       1.95455366       1.92832533       22      -0.39434324      -0.71452253       0.81722070 
Al       0.01945690       3.89229392       0.00217352       13       0.28234930      -0.44761488       0.06134548 
Al       1.97595651       5.84532615      -0.01364113       13       0.65067149      -0.32662510       0.01012116 
Al       1.98504053       3.92802606       1.98954287       13       0.47035849      -0.83589606      -0.67187293 
Ti       0.02601733       5.87819456       1.94833562       22      -0.52463719       0.33733980       0.67163421 
Al       3.91346379       3.89524000       0.01810946       13      -0.73731400       0.19374001      -0.93804252 
Ti       5.90011941       5.88093941      -0.03175522       22      -0.26204194      -0.54918976       0.49087197 
Ti       5.83376193       3.87239221       2.01028796       22       1.65017015       0.57637560      -0.27572141 
Al       3.89164793       5.83355381       1.91461340       13      -0.43363804       0.34447465       0.01282742 
Al       0.02925808      -0.00024163       3.93063217       13      -0.27064555       0.43472590      -0.01026602 
Al       1.95614623       1.97701396       3.94020234       13       0.09087772      -0.51848261      -0.77939059 
Al       1.93226185      -0.01756992       5.82763412       13       0.12924723       0.04635590      -0.25776663 
Al       0.01993018       1.96351190       5.87247198       13      -0.17904319      -0.52747274       0.26223389 
Al       3.91545446      -0.02962165       3.91673904       13      -0.72415532      -0.93851160       0.32389703 
Ti       5.85387681       1.95567910       3.89006128       22       1.15343190       0.06838437      -0.15976127 
Al       5.88667943       0.00028279       5.86448285       13      -0.00875411      -0.28684191      -0.02846865 
Ti       3.90238442       1.96045705       5.87445945       22       0.13497567       0.34318034       1.22690033 
Ti      -0.02375286       3.87426775       3.89751559       22      -0.93796910       1.07909759       0.15342077 
Ti       1.95771681       5.86599932       3.89858066       22      -0.29831782       0.92445670       0.46644051 
Ti       1.98629602       3.88312795       5.87869561       22       0.02086426       0.77439061       1.00854926 
Ti       0.01534044       5.86058943       5.86532610       22       0.25557800      -0.39175717      -0.29086328 
Al       3.92111365       3.87802558       3.89794598       13      -1.32281052       0.35553811      -0.51906477 
Ti       5.90564700       5.84471610       3.92442169       22       0.25818623       0.26803549      -0.32689780 
Ti       5.87166430       3.89757392       5.87372111       22       0.33820737      -0.28017794       0.32908000 
Ti       3.93878373       5.87114210       5.83596301       22      -0.27292712       0.26760453       0.29251859