32 Lattice="5.20728569103563 0.0 0.0 0.0 5.20728569103563 0.0 0.0 0.0 5.20728569103563" Properties=species:S:1:pos:R:3:forces:R:3 energy=-92.00396653925371 stress="-0.6100211417244144 -0.0194886068641123 0.006965418181902668 -0.0194886068641123 -0.62864777697366 -0.013279594925407116 0.006965418181902668 -0.013279594925407116 -0.6482848114351549" free_energy=-92.00396653925371 pbc="F F F" C 0.00106951 0.02123521 0.02378827 7.42606002 7.98070161 8.38858252 C 1.30420367 1.32114056 0.00920523 -8.55685355 -9.47250075 -17.43953707 C 1.32204856 0.02496413 1.30336867 -7.37059584 -15.36646313 -10.72820628 C 0.01231397 1.31345559 1.31537448 -17.49362732 -9.96332682 -10.59249402 C 2.59553467 0.00276593 0.00682917 5.68737854 3.69242660 3.91133354 C 3.88327291 1.31885978 0.02263619 -3.36269418 -5.39149728 2.96593622 C 3.88764976 0.01255418 1.31981053 -3.70165093 2.17356410 -5.49962607 C 2.60949483 1.28943255 1.32270812 10.74674840 -10.73474854 -7.40827798 C 0.01683941 2.58064546 0.02996708 0.93822144 3.92581434 0.43811904 C 1.30426998 3.91293807 0.02372399 -5.50808151 -2.33224263 3.45767826 C 1.31485137 2.60268912 1.28560300 -5.75980588 9.47080992 -9.40201977 C 0.02154516 3.90088047 1.32562540 3.50292733 0.20641475 -4.68329758 C 2.58516286 2.61337386 0.02547227 9.35080886 9.59258796 -13.82675789 C 3.90368080 3.92663511 0.00542130 -9.28570990 -8.22701450 9.57126441 C 3.91473929 2.60212408 1.30053583 14.60138231 8.76479363 -9.98331254 C 2.61912747 3.91195127 1.31842813 11.28996210 14.73141891 -8.19097926 C 0.02010317 0.02475419 2.58026667 1.14628644 -0.25241678 5.47367680 C 1.29008500 1.30703912 2.62618292 -4.25098819 -7.14987120 10.32536559 C 1.29450563 0.02302276 3.89422075 -6.09533829 2.81224410 -1.99558029 C 0.01451583 1.31268123 3.88405258 1.35524145 -7.02063914 1.04292958 C 2.62099797 0.00164422 2.59121072 11.50146150 -13.54739160 8.98077843 C 3.91306896 1.31109650 2.61806153 12.14603912 -9.71635105 12.70135794 C 3.92728233 0.01137980 3.91995616 -8.18209410 9.72551122 -10.67969366 C 2.57964891 1.32335297 3.89834254 9.17487494 -6.86466354 11.68002754 C 0.02073036 2.59266299 2.59363616 -16.44652680 10.00367373 8.66501153 C 1.28994307 3.89941888 2.57801341 -9.48559089 13.58713339 7.67932661 C 1.28163813 2.60448958 3.91621608 -7.00663363 11.93650003 13.89593272 C 0.02594951 3.89399276 3.89147790 9.27789125 -7.64823086 -6.86646667 C 2.62901250 2.61497915 2.59092926 8.49022837 11.58521206 12.03021369 C 3.92555910 3.88171861 2.57783897 -3.74557734 -3.93098554 3.62532641 C 3.88610990 2.59764592 3.91610528 -7.25714673 7.01501637 -3.31741065 C 2.60790569 3.90286290 3.92115275 6.87340297 -9.58547936 -4.21920113