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=398.177482675 stress="-8.0134476166335 -0.2825253294615414 -0.0258523661890895 -0.2825253294615414 -7.3938689428217375 0.01472162337410502 -0.0258523661890895 0.01472162337410502 -7.967100226552788" pbc="F F F"
Se      -0.16821827      -0.11676220      -0.23807589     -12.17121262     -12.19755662      -8.76287763 
Cd       1.46490969       1.26260376       0.12263099     -38.99298282      20.71200630     -54.26751985 
Cd       1.54530481      -0.04793993       1.63330069     -21.74230929     -52.79017787       4.82821023 
Te      -0.15999292       1.40406773       1.15407465     -36.92514433       0.05167290       0.70297010 
Te       2.70122014       0.23212867      -0.24705295      19.76231260     -40.30857250     -35.57472065 
Te       4.26067717       1.85729586       0.19104769      32.62420539      -9.88721268     -40.00252451 
Cd       4.46850990      -0.04716377       1.28353165      19.59047788     -20.64553390      -8.12357759 
Cd       2.70072959       1.51229390       1.34628414      24.35285565      11.70030745      19.86982697 
Se      -0.20938248       3.32691649      -0.28843667     -14.96110508      -3.13770621     -15.22727267 
Cd       1.41738082       4.65093924       0.14803915       0.24820933      25.61092727     -28.19943068 
Se       1.26416454       3.14526935       1.53806039     -12.38141215     -13.40389440     -12.04051105 
Te       0.07797747       4.76599513       1.52294350     -26.44249050      23.85138654       5.19522096 
Se       2.82778361       3.11396342      -0.00490765      -0.15562335       5.41390619     -36.80433628 
Te       4.53099333       4.69045800       0.07166715      29.29738196      16.16564110     -28.99402263 
Cd       4.42588762       2.71223271       1.67379638      39.49806786      27.36479065      -2.27733316 
Te       3.16522205       4.45742157       1.37252202     -17.12346373      32.91557384     -15.16389054 
Se       0.03320948      -0.05942796       3.42273282     -21.00433589     -18.75505750      -7.97705442 
Te       1.55646809       1.51429135       2.89127906     -24.43013650       3.69901730      17.90519793 
Se       1.66164111       0.02184289       4.65019543       7.22906687     -17.62171328      19.08463066 
Cd       0.13350600       1.46747521       4.73454065     -18.06604081       7.36579891      19.70051957 
Te       3.03480345       0.03310309       2.81305510      14.25969013     -44.37987162      15.08452762 
Cd       4.34472026       1.46070040       2.99928290      33.40983481     -14.04901861      14.10266331 
Se       4.73956773      -0.27442627       4.40977949       8.99571169     -11.33480351       7.12680599 
Cd       3.28264895       1.47537525       4.70902946      -8.46553031      -9.03335298      33.26459751 
Se      -0.20409991       3.16265408       2.95840249     -30.42143398      -5.80463685       2.10349229 
Cd       1.81872804       4.23417086       2.94170993     -20.90886323      58.19380542       2.54658316 
Cd       1.68168807       3.14109445       4.53839703     -12.52465774     -15.73992029      40.62383515 
Se      -0.04623943       4.22340307       4.61951579     -14.06388399      14.95340262      15.27098087 
Te       2.96781377       3.13443557       3.06717778      26.93865173     -21.25525519      18.14946162 
Te       4.44125040       4.72475079       2.77927999      38.45448753      27.47581152      24.39982026 
Se       4.77544140       2.75162633       4.78148913      21.47130616      10.54402779      11.68458016 
Se       3.05210001       4.46864501       4.76147517      14.64836673      24.32620820      21.77114732