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=906.732652808901 stress="-2145.8671581464037 -110.62355739559365 -126.7780262187805 -110.62355739559365 -2099.762802051967 27.866180834428462 -126.7780262187805 27.866180834428462 -2108.7709993589283" pbc="F F F" Cd 0.20270815 0.27898347 -0.07521597 -51.69748757 -43.81720707 -36.65455530 Zn 1.37238155 1.11426164 0.21823327 -10.08197910 10.66615608 -51.54055827 Zn 1.35744396 -0.19047560 1.38918897 -22.67640573 -63.77575973 17.33432346 Hg -0.24809902 1.26525724 1.33922355 -52.74741968 4.52744286 -35.41548545 Cd 3.36940027 0.25742332 -0.14471015 -75.19826281 -105.94867774 -74.49884950 Cd 4.37586444 1.25440511 -0.28213978 105.64788453 64.88838883 -61.70601412 Cd 4.25343351 0.04415581 1.24339370 64.58716457 -67.08601101 26.63364841 Te 2.91081559 1.44917887 1.45220687 23.30243178 -32.67325922 -27.28026066 Se -0.14412507 3.05500849 -0.15675941 -50.46992416 -2.84395429 -35.20570386 Se 1.24192238 4.68946557 -0.29024230 -8.03488852 40.57864858 -44.55210484 Cd 1.44867012 2.80315192 1.32206028 -36.26073240 -0.99581595 -34.47624906 S 0.15571493 4.77666978 1.77925960 -85.93423485 38.71636147 -52.22043923 S 2.90223075 3.02498372 -0.04096980 1.34938468 20.45064737 -76.52647105 Te 4.24802762 4.45375095 0.06683225 43.79382317 55.88665970 -51.47686684 Zn 4.43927127 3.17093812 1.34478645 73.18494504 10.22502381 -5.77166695 Se 2.87633299 4.73720612 1.42102365 15.67732474 77.00044523 0.08589395 Hg -0.14686464 0.24257962 2.98785390 -36.56640753 -58.52294309 26.84944150 Hg 1.70196160 1.48101872 3.21531963 -11.79303683 -32.25834139 -8.11695801 Zn 1.63900143 -0.03457635 4.41918787 -14.24633477 -53.29641575 19.55354439 Te 0.16333169 1.70242272 4.56139068 -66.41219418 -21.55981367 59.89662701 Zn 3.27195272 0.01666064 2.94900785 4.05122669 -63.22858525 17.16756829 Cd 4.39006667 1.32937731 2.79185975 70.87427483 -9.00458322 18.07581170 Hg 4.75386859 0.03152318 4.25008333 21.33949305 -19.66917782 12.99438723 Se 2.82523637 1.45446512 4.68364777 66.41362017 -67.58140495 94.59930987 Te 0.21362006 3.15569519 2.87564235 -82.05162342 26.74040183 9.98551265 S 1.45625491 4.76845365 2.93256865 36.69482958 66.65963342 59.35467109 Se 1.58972426 2.73017696 4.48792116 -54.32497135 93.26151187 71.38699978 Hg 0.00385152 4.74566581 4.77642377 -12.86455437 20.21495343 23.33269247 S 3.15143204 3.01384413 2.98290951 20.38298026 4.82720844 10.12147952 Hg 4.74934237 4.24574113 2.88822288 45.68701148 38.32914508 -0.85305762 Te 4.53068862 2.88302957 4.34442536 73.69591544 9.93199626 68.47224012 S 3.39791210 4.32567919 4.53209935 4.67814725 59.35732589 60.45108929