64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=218.2726505752462 stress="-0.0013355997543198054 -2.496044839335979e-05 -0.0005408750073988486 -2.496044839335979e-05 -0.001441601786134243 0.00011788356157937866 -0.0005408750073988486 0.00011788356157937866 -0.0012275149753685265" free_energy=218.2726505752462 pbc="F F F" O 35.22086729 34.98310996 34.77096654 -4.91867034 -5.19467929 -6.16564754 O 36.15142137 35.93572417 35.98055861 -4.02591243 -15.82359056 16.87614861 O 36.67756578 37.22516294 35.23402360 7.81593186 19.74933626 -12.46821663 O 38.60714772 38.38846909 36.18004449 -9.07075223 2.12238690 -13.40333772 O 37.66099888 35.43120791 38.14671993 -50.38701149 -21.34913015 -32.07912066 O 38.78275119 35.88656467 38.85899891 47.44418440 22.73519290 26.12777568 O 34.86273032 37.66171571 38.07174639 -1.72161175 -0.62282583 -0.65605615 O 36.55604684 39.07636534 38.99475015 -33.31099948 81.67849470 -47.56110273 O 40.05873752 35.10223056 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