32 Lattice="7.55506616845391 0.0 0.0 0.0 7.55506616845391 0.0 0.0 0.0 7.55506616845391" Properties=species:S:1:pos:R:3:forces:R:3 energy=-207.36341896191115 stress="-0.0473747869427151 -0.0017602888024554173 -0.011204926661701848 -0.0017602888024554173 -0.04394735375619447 -0.003965838341053796 -0.011204926661701848 -0.003965838341053796 -0.050395193431013105" free_energy=-207.36341896191115 pbc="F F F" W 0.05174266 0.02549798 0.03770587 -1.26048423 0.06180047 -0.74375003 Re 1.88936328 1.87702448 0.03115395 0.59165059 0.99008706 -1.52679755 W 1.89474454 0.00895870 1.85109332 0.39432793 -2.07611001 1.68137351 W 0.00957733 1.92208573 1.90900758 -1.44783478 -0.67747624 -0.80622109 W 3.81032483 0.00877515 0.01276183 -0.74679912 -0.66030876 -0.79745489 W 5.63452158 1.91312257 0.02914549 1.76615217 -1.61194886 -1.33519802 Re 5.65169793 0.02063785 1.87572253 0.40632375 -0.29696196 0.75988475 Re 3.75538385 1.82067987 1.93404188 0.90987429 0.83880673 -0.45934659 W 0.03600650 3.81012605 0.02482161 -0.49295894 -1.44953716 -0.96502368 Re 1.85400475 5.66756661 0.00501994 1.15074295 0.11487800 -0.09998997 Re 1.91278522 3.75419283 1.92050961 -0.22229850 0.38399419 -1.15219630 W 0.04683162 5.65799109 1.87796779 -0.31801760 0.90937400 1.05094131 W 3.80615508 3.76436028 0.02057817 -2.89372884 1.29067388 -1.69472797 W 5.63526553 5.68819719 0.03021779 0.45643950 -0.06084065 -0.54213450 W 5.65601192 3.78145018 1.85274532 1.97998794 0.81817644 3.12022321 W 3.78152836 5.69197682 1.88429108 -0.83584349 0.69260483 0.55371593 Re 0.01240716 0.04496342 3.77798262 -0.77976200 -0.77265929 -0.36227275 Re 1.88089622 1.81718388 3.75796578 -0.13271060 1.51286534 0.70659328 Re 1.87542174 0.02715173 5.63913588 0.46217911 -0.53208320 0.84193249 W 0.00297459 1.86239339 5.70393445 0.28284769 0.68705378 -0.23926745 Re 3.80969256 0.03157594 3.84729500 -0.07252696 -1.40878253 -0.68224704 Re 5.69419214 1.88541585 3.79456440 0.55132297 0.34856835 -0.37387980 Re 5.67602621 0.02389514 5.64759318 -0.14606170 0.43092882 0.29631715 W 3.77857718 1.92323188 5.68637830 0.55808115 -0.52052777 0.83390172 Re 0.00417008 3.77397794 3.74026273 -0.55885796 0.49325112 1.41819835 Re 1.91093083 5.65548258 3.76999101 -0.40011506 1.00504656 0.60699267 W 1.90445908 3.79464195 5.66833191 -0.96924016 0.45703809 0.64663219 Re 0.02506096 5.69626468 5.69506070 0.86428817 -0.95733364 -0.86498057 W 3.74160568 3.74545928 3.74153659 1.79075560 0.85972692 1.06595008 W 5.66454995 5.66320636 3.78187414 -0.46938872 -0.22242898 -0.63307697 Re 5.65977035 3.81159244 5.64392884 -0.03292453 -0.53959700 0.04065566 Re 3.79405897 5.67395617 5.68490192 -0.38542060 -0.10827852 -0.34474711