32
Lattice="8.920409335298043 0.0 0.0 0.0 8.920409335298043 0.0 0.0 0.0 8.920409335298043" Properties=species:S:1:pos:R:3:forces:R:3 energy=-26.51468218544619 stress="-0.01229809113933792 0.0017369128890145744 0.004084902886799223 0.0017369128890145744 -0.01989458409832271 -0.005307050379345675 0.004084902886799223 -0.005307050379345675 -0.013531274347939132" free_energy=-26.51468218544619 pbc="F F F"
Hg       0.05670782       0.00452383       0.03101120       0.09536159      -0.62138398      -0.20536490
Cd       2.25902110       2.18020390       0.03373746      -1.24519147       0.75582126      -1.45411688
Se       2.27374058       0.03671360       2.19477492      -0.76214681      -1.63459628       0.61276775
Hg       0.00301505       2.19539660       2.19056742      -1.58418831       0.76340226      -0.98116376
Se       4.49749496       0.03475581       0.07604076       1.75491358      -0.15168862      -0.86564925
Cd       6.67815721       2.25190691       0.03167715       0.46833515      -1.12213501      -0.79470470
Cd       6.68489470       0.00548292       2.20739240      -0.87374480      -0.28565625       0.37622410
Hg       4.46226006       2.22711450       2.26299884      -0.08229207      -0.72588382       1.44952184
S        0.00039708       4.47864530       0.03713205       1.69889685      -0.11186691       2.17337246
Te       2.25907451       6.65735554       0.08310242      -2.90925312       1.31050920      -0.27386551
Zn       2.27385824       4.44804768       2.25342320      -2.01967664       1.00758254       0.54577200
S        0.00518012       6.73128678       2.27169677       1.79813570      -2.02388970      -0.01841245
Te       4.48094630       4.43322867       0.00809654      -0.83188245      -3.20301908      -4.65538136
Te       6.65745600       6.65766541       0.03748435       2.37143767       2.30084785      -1.09756827
Cd       6.65258338       4.43722681       2.24508081       2.59571572      -0.50379971       1.92976606
Cd       4.49270617       6.72114818       2.21180983      -0.46875724       3.11880408       2.68447445
Se       0.00093721       0.07007509       4.46286355      -0.13240343      -0.10066130       0.78149336
Te       2.19682557       2.26511812       4.46010901       4.18217298      -2.21822807       0.26057807
S        2.19200958       0.01116389       6.65308786       0.27399300       1.00069021      -1.19212583
Hg       0.02574266       2.20595825       6.71032166      -0.83124062      -1.86140011       1.22717886
S        4.48252492       0.01843048       4.46363379       0.85659859       1.23003876       0.85483885
Hg       6.64666168       2.21834305       4.44493369       0.11407006      -1.49192903       1.17380857
Se       6.68874942       0.00167452       6.73248438      -1.65196849       1.56680394      -1.37469571
Zn       4.50169127       2.24968441       6.66490725       0.54157622      -1.82161946      -1.05902219
Te       0.02436948       4.42851970       4.48715976      -3.09211539       3.86239711      -1.69285166
Zn       2.26820084       6.71998914       4.45524775      -0.73161690      -0.43713114       0.23540675
Cd       2.19541132       4.43511457       6.72197655       1.77301408       2.49198106       2.51151285
Se       0.03515997       6.66633960       6.66625646       0.99260511      -0.28788208      -0.68954801
Zn       4.52049296       4.47962483       4.50206444      -0.04511643       1.27729053       1.20840056
Zn       6.67468750       6.70639227       4.46437613      -1.23453818      -0.60138552       1.18635331
Hg       6.69009997       4.46456068       6.65805340      -1.14729985       1.11851202      -0.14363987
S        4.49462866       6.68686875       6.70161264       0.12660588      -2.60052472      -2.71335947