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=-21.49228328371828 stress="-0.0007487570381713087 -8.40860958074393e-05 -0.00011076912273089357 -8.40860958074393e-05 -0.0008204518548769983 -3.1060092309296053e-06 -0.00011076912273089357 -3.1060092309296053e-06 -0.0007334344254974715" free_energy=-21.49228328371828 pbc="F F F" As 34.75900849 34.98477095 35.64594072 -3.42309497 -1.38109164 -0.91570227 As 36.59933616 35.93572417 35.98055861 -3.34074048 -6.60019130 2.12338575 As 36.94501188 37.22516294 35.23402360 0.49790709 10.90920690 -10.09476700 As 38.38021302 38.78131475 35.96390753 2.30688202 2.53585532 -8.75923554 As 37.29465675 34.93158033 37.42454113 -1.94662517 -7.67809526 5.74795354 As 38.85840215 35.76443239 38.07792206 4.08737446 -1.16202834 4.00895260 As 34.87364502 37.87128473 37.41689395 0.02675914 -0.66040487 -0.84388385 As 36.55604684 39.07636534 38.99475015 -11.92573507 17.14603781 -6.90399076 As 40.66546038 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42.11536967 42.13716159 -6.67539263 11.87117328 13.23970072 As 41.28385059 43.81962023 43.41712439 2.37189550 0.70568087 -0.46726968