12
Lattice="6.231497490622015 -1.079054631135251 3.591184333128187e-16 -1.147660325495526 6.217288737110981 3.387562580229452e-16 3.627013443639441e-17 -3.159623081391114e-18 20.860254262637547" Properties=species:S:1:pos:R:3:magmoms:R:1:forces:R:3 magmom=0.0 energy=-51.211556683658614 stress="-1.3340966372066363e-05 1.3986096775607027e-05 1.659288719846396e-05 1.3986096775607027e-05 -1.3775291117151755e-05 -4.895165318101458e-06 1.659288719846396e-05 -4.895165318101458e-06 3.0331979442644917e-05" pbc="T T F"
Pt       0.04437986       3.76460170       9.52917884       0.00000000       0.00502623       0.00114956      -0.00075989
S        5.00334974       1.39873577      11.08913340       0.00000000      -0.00307553       0.00143853      -0.00070908
Br       5.00336304       1.39890916       7.72173998       0.00000000      -0.00055065      -0.00066987       0.00013736
Pt       0.61963530       0.65554618      11.33173336       0.00000000      -0.00701794      -0.00125599       0.00386264
Br       4.43423832       4.50350583      13.13849242       0.00000000       0.00057091       0.00461114       0.00162525
Pt       3.73352831       0.10979895       9.52904248       0.00000000       0.00024281       0.00066498      -0.00603464
Pt       3.15971665       3.21883473      11.33138193       0.00000000      -0.00074429      -0.00537750      -0.00685060
S        1.88800183       1.93749216       9.81866382       0.00000000      -0.00045805       0.00372576      -0.00397262
S        1.31722217       5.04442345      11.04177608       0.00000000       0.00250349      -0.00322346       0.00510353
I        1.31562796       5.04574692       7.50000000       0.00000000       0.00019049      -0.00078367       0.00191199
S        4.43207585       4.50620404       9.77124734       0.00000000       0.00364221       0.00029567       0.00374488
I        1.88874572       1.93763694      13.36025426       0.00000000      -0.00037377      -0.00056809       0.00193324