64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=425.982510902 stress="-1.3714595582433822 -0.30562450162251553 -0.0849683548301858 -0.30562450162251553 -1.042219852392747 -0.1477069247409259 -0.0849683548301858 -0.1477069247409259 -1.006918560269055" pbc="F F F" Te 0.19334357 -0.05743599 -0.24065558 -0.75177402 -1.06327717 -1.80436198 Zn 1.05594887 1.59740117 1.29193364 15.89413155 -10.70182450 -13.63775324 Zn 2.38052511 3.15905631 0.12494544 -23.52343800 -4.56551739 -14.17709403 Cd 3.68940147 3.44969672 0.81672507 17.95864330 4.36802754 13.18955529 Cd 1.66549853 0.43241071 2.79677122 7.30541501 -5.46559765 1.99104883 Zn 4.25634488 1.21052209 3.77165518 -10.04299755 1.75478543 -5.19450928 Te -0.12909412 2.48454463 2.01909480 -22.84070665 14.31508018 8.01934082 Te 1.58311282 4.06136907 3.62227079 -34.47476653 -0.41782292 -10.31073102 Te 4.50097913 0.48913490 0.45080492 -18.51004790 -17.17283616 -7.09045655 Te 5.91230307 1.76494492 0.99576873 -15.30591348 11.24418977 3.93369820 Te 7.50918987 2.64241888 0.18251839 14.36281692 2.01558135 -24.20238975 Te 8.40557237 4.08961417 1.40786631 29.36714897 -7.18484332 -11.01570067 Cd 7.19416561 0.69546349 2.12260224 13.32244374 -16.32635804 13.86566806 Cd 9.12446978 1.55255658 3.93927595 12.59266985 -4.11336663 -5.89458372 Zn 4.93673510 2.61415847 3.24036996 -2.10461899 4.87019020 -3.96150666 Zn 6.17518538 3.86201272 3.46527038 -2.08138854 -1.49669466 4.03256433 Cd 0.06715157 5.39207830 0.41824379 -164.72519480 -101.34151845 -117.00748284 Te 0.92442730 5.89265087 1.01668972 159.07742938 84.11686775 96.85544362 Te 2.44989393 7.90830103 0.49146357 -20.60577927 -10.16574586 -15.96750549 Te 3.89308191 8.87905014 1.07989349 19.86720859 29.75009189 0.80528092 Cd 2.37593432 5.29802678 2.62077654 24.04645363 20.28400144 -18.42108891 Te 3.92829168 7.03518576 3.32506035 -2.54610899 -17.58886205 9.02216147 Cd 0.15440537 7.37324420 2.23824761 -14.53685078 11.21964694 2.27748485 Te 0.98846209 8.12459065 4.10155219 0.55971236 8.32707790 10.19709781 Cd 5.60573954 4.72074077 0.24473016 1.02378399 5.44352426 -4.03105897 Zn 6.14820520 6.86118365 1.66374457 12.48459238 -4.76616369 -7.01673830 Zn 7.33616807 8.29406543 -0.20429106 -0.40116751 -0.12621023 -0.43927100 Cd 9.15020825 8.55188066 1.41681414 0.44654563 -0.21303705 0.69803018 Cd 7.29653441 5.10905276 2.57420743 -40.29212961 -1.56319446 -2.71562241 Te 8.57124259 6.04463286 3.33743463 33.20723954 25.87638746 21.00526431 Zn 4.90051697 7.57769927 2.12835811 8.51732234 7.17672533 -8.88635723 Zn 6.52825393 8.73844466 3.66790847 -11.16881518 14.54301873 -23.98936732 Cd 0.07662736 -0.03257783 4.50328062 -3.26015250 -1.14959236 2.86744714 Cd 0.97274823 1.59761753 6.69630969 123.95503522 -42.48422876 -93.66642322 Te 2.22394685 2.88691646 4.70796593 11.76776126 -36.20252889 20.61584930 Te 3.89120336 3.94034826 5.91004333 -86.97925116 -83.31456039 57.17995662 Cd 2.29647169 -0.05706565 7.87574269 -30.02695881 -17.63706503 -14.63512765 Te 3.77895662 0.49285301 8.64727649 34.94475559 12.79870723 18.02126740 Cd -0.06593730 1.94955937 7.44213993 -131.72329014 44.86088586 94.64732214 Cd 1.99910441 4.32306980 8.32847865 -13.75502278 -15.69158030 19.68771821 Cd 4.95954072 -0.04933599 4.65630510 3.67282440 -14.22292845 4.99089231 Zn 5.76150999 1.10847566 6.33237920 4.38582827 -32.38348178 -15.08663778 Te 7.20254025 2.13466653 4.91615749 -7.08624859 4.79692167 -0.81773653 Te 8.82181386 3.83827153 5.78811915 2.89112477 4.82489064 4.04176069 Te 7.65755399 0.03048830 6.69780234 5.35819282 -5.76909983 2.76871836 Zn 8.43797677 0.89557243 8.88628669 0.36173747 0.68600421 0.84701247 Zn 5.42076638 2.07165220 6.90637308 -13.05196995 32.91985948 22.68699018 Zn 7.03493861 3.30043228 8.71121304 0.50152024 -1.32288512 0.55303730 Zn 0.35259825 5.25166882 4.90712644 -11.48173827 -1.47567159 -1.73708433 Te 1.65403250 6.07514706 6.10334420 -3.20621559 12.55682470 -4.79590072 Zn 3.22845061 7.77270109 4.69863249 -7.15598842 8.34992747 16.56879778 Zn 3.76960686 9.07023619 6.60707136 0.49431760 0.33644217 1.40925811 Zn 2.72406432 5.19978234 7.30048196 20.31105913 9.07276070 -3.46055149 Cd 3.17196660 7.06280654 9.02821695 0.27048473 0.95618124 0.96835147 Cd 0.47455462 7.82172885 7.68061798 -47.95017683 -78.33853795 -54.19575555 Zn 0.92921781 8.66554559 8.27036106 45.14255056 81.55257662 57.26568956 Cd 4.83445896 4.71844325 5.43743629 84.30329304 62.52031339 -64.37348959 Cd 5.90584488 6.09539990 6.20287457 12.85220294 23.45872687 1.86558370 Te 7.17832991 8.07606540 4.93927022 12.83060148 -10.68889421 24.14301555 Cd 9.15407332 8.76753235 6.82989220 0.57714053 0.47182111 0.30858077 Zn 6.87494686 5.25557940 7.52746170 7.07204992 -4.87837609 5.88236064 Zn 8.77911979 6.03577414 8.96998693 -0.00467387 0.14318539 0.07280586 Zn 5.33900509 6.95961827 7.85568600 -6.81835271 -3.34870508 -1.46953601 Cd 6.05903169 8.17669666 8.93022098 4.68570032 7.56978116 6.71676799