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=1460.6587958006348 stress="-14.348140782559677 -0.10195033672918598 0.5882585150948968 -0.10195033672918598 -14.185509782043445 0.24769479281210408 0.5882585150948968 0.24769479281210408 -18.151349963480854" pbc="F F T" Hg 0.23902795 0.14496549 -0.00043557 -89.01915147 -46.17852212 39.43281366 Zn 1.68632283 1.62732549 0.01126252 -33.43681908 -31.74284720 -13.28347908 Se 1.48755167 0.09156143 1.37080658 18.17428219 -114.02994620 -21.12909203 S 0.16324474 1.53092536 1.58841866 -102.21656842 -24.63459627 -30.29160595 Zn 3.33805240 0.04014536 0.12270320 -27.13431739 -102.71335512 -14.06390387 Zn 4.37743157 1.14803887 -0.16627725 78.86213730 41.13931459 -24.84699726 Te 4.73220343 0.10486073 1.25251397 77.10594757 -65.98782956 13.94216204 S 3.09949768 1.49763063 1.28087408 18.45055934 -40.36912879 -6.31322438 Cd 0.16570550 3.15449877 0.23496256 -99.81331010 14.01437432 -26.94774869 Te 1.33627702 4.53433807 0.02685734 -35.42529060 125.47942946 -26.82075770 Te 1.58121191 3.03698926 1.74009865 -38.61966404 40.38129696 -51.48966410 Hg 0.12980588 4.73768871 1.50135465 -53.64383366 52.55242072 -9.20267224 Hg 2.75028793 3.09283576 -0.02417800 15.04070281 2.56651496 -31.77788250 Hg 4.50405772 4.68683508 0.08633981 45.66876785 48.13794953 -22.62691736 Hg 4.30454036 3.26222744 1.48386228 92.56893006 7.61578309 -15.71032895 Cd 2.89098618 4.41026484 1.43568753 52.56213726 100.66126140 -25.06838523 Se 0.07316231 0.00015289 2.92464613 -58.11886069 -76.82711784 20.42215529 Cd 1.32829899 1.60126778 2.77713041 5.85113914 -75.43959182 28.65165700 Hg 1.30156820 0.18004196 4.70510863 58.91638937 -65.98887255 -47.96360654 Te 0.26021619 1.39960621 4.22029216 -132.31356642 -30.94842616 48.41281084 Zn 3.28157323 0.28177659 3.10287047 -16.38457198 -97.89237150 18.61486231 S 4.36699129 1.27959717 2.76811067 120.24299456 -8.22426108 29.16848387 Se 4.61186300 0.06191554 4.41009887 43.39435293 -51.08655509 -11.80360950 Zn 2.58591852 1.67136675 4.64825431 23.28380192 -28.70750894 -20.02252093 Se 0.12701537 2.82701799 2.72051468 -134.76482880 42.29125860 35.53409748 Cd 1.28051281 4.71969868 2.70939993 -34.08038650 110.48098011 9.75999690 Cd 1.78556070 3.15546038 4.28726075 -20.24616124 15.75733526 34.01034675 S 0.24193565 4.27054643 4.21614391 -77.12926914 59.19180285 31.14951581 Te 3.21265502 2.99902276 2.88157386 84.46375284 6.08585963 41.44496783 Se 4.31583024 4.25560760 2.87076474 96.97637044 81.79653026 24.01109489 Cd 4.36714264 2.89050528 4.66359548 80.36400244 28.22965571 11.25413395 S 3.00603751 4.52113079 4.43301893 40.42033150 84.38916281 13.55329771