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=320.737526398 stress="-8.768768650450047 -0.02864135444859458 -0.41012566519019206 -0.02864135444859458 -8.01246265896573 -0.3415104431686573 -0.41012566519019206 -0.3415104431686573 -9.040294328335474" pbc="F F F" Au -0.14459490 0.11115480 0.11044915 -13.97584496 -21.67091545 -24.69012538 Au 1.70960170 1.31143450 -0.16166483 -10.21071232 11.62468061 -18.72046141 Au 1.28829595 -0.16490224 1.64041416 11.80797730 -28.09285856 -9.77713743 Au -0.22187219 1.51878885 1.32834452 -18.55972283 16.63758716 11.27375591 Au 2.91048585 -0.04105180 0.20259391 0.47303300 -33.71372094 -16.30572096 Au 4.56504129 1.20865944 -0.13449789 19.08300565 10.56736715 -23.06934110 Au 4.28802619 0.22277084 1.68584377 27.89969456 -45.54064402 -21.09536460 Au 3.18362810 1.69581920 1.64685009 -20.76629426 -22.68382511 -8.86614464 Au 0.26959405 3.17626233 -0.14597521 -22.78886441 -18.45615234 -36.79966993 Au 1.70996341 4.49207130 0.15300231 -10.79987364 50.11007730 -45.34734595 Au 1.53848316 2.95774659 1.44451093 -27.85848627 -23.83488222 12.35629051 Au -0.04210664 4.38825682 1.27041603 -26.36018997 26.09217699 16.98596504 Au 2.91508268 3.17895518 0.29140871 11.83749949 -21.75756821 -61.17303124 Au 4.61455359 4.53253581 0.14904689 16.60030534 22.94820346 -21.52128701 Au 4.28091226 3.10609294 1.42979433 54.22106543 -21.71846735 -7.35325620 Au 2.80598025 4.32157598 1.51361598 14.35185933 59.82873718 14.41074000 Au -0.14801295 -0.02432459 3.06329927 -41.53574522 -23.07786508 -11.99645302 Au 1.43745442 1.27846858 2.90034971 5.47331429 23.95182516 -0.48375718 Au 1.34126820 -0.15859300 4.31668137 5.23868057 -45.03096102 23.12859868 Au -0.08013605 1.24396547 4.59073906 -19.26274976 20.91479449 24.53056915 Au 3.27219963 -0.06618674 3.13132919 -23.49114256 -32.80715114 5.46879505 Au 4.75978669 1.22592512 2.78504734 43.98034031 33.69107349 21.85750276 Au 4.68365717 0.20288723 4.58343331 15.30435622 -7.80909449 24.49286771 Au 2.55145119 1.14987927 4.72094491 15.67837294 22.25021666 25.74961681 Au 0.23171545 3.18190327 3.12058324 -38.31779439 -24.01309913 -24.26312827 Au 1.71219253 4.42485375 3.12990665 -8.68385929 50.16977262 -19.12842547 Au 1.28220450 3.28278197 4.56210000 15.62541095 -47.22736314 40.81635763 Au 0.13362859 4.32702941 4.57034430 -41.17419235 42.48880874 29.59899048 Au 3.04852473 3.05473499 2.91561068 -8.45672969 -24.45989509 23.90512441 Au 4.63661615 4.40480033 2.65010476 26.23988396 33.05001576 13.19586306 Au 4.29869006 3.11041876 4.26735611 33.40795728 -17.56898458 25.38914064 Au 2.83533445 4.24148635 4.58611608 15.01944531 35.13811111 37.43047193