32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-21.306666747381225 stress="-0.003935457688620475 -2.771670217031516e-05 0.0002221879031459616 -2.771670217031516e-05 -0.0037869178873473908 5.345137600416644e-05 0.0002221879031459616 5.345137600416644e-05 -0.003659266033698925" free_energy=-21.306666747381225 pbc="F F F" V 21.21005355 21.21211731 20.94968690 -3.77054082 -4.05503610 -7.41841472 V 22.62524129 22.65710459 20.99042854 2.60736653 -6.20870930 -8.56976677 V 22.14435048 20.97664413 22.63599647 7.56178311 -13.41895589 -1.79006222 V 21.02201293 22.19628152 22.70629937 -11.98826377 8.06554244 -2.46071429 V 23.98566276 20.81443107 21.04376171 -3.28876088 -5.38908720 -4.67069336 V 25.22051529 22.51738578 20.80722932 6.17953115 -0.01549414 -8.07186350 V 25.26172667 21.05332204 22.38436473 8.19473198 -6.90706671 0.74216916 V 24.23110688 22.75824968 22.51283276 -2.85000482 -7.57011732 -13.02041054 V 21.20071341 23.82858036 21.14720807 -15.90551812 -7.92703962 -15.11529519 V 22.58942344 25.45706424 21.27559981 6.35208439 16.67406966 -13.20719638 V 22.21321713 24.21736445 22.28604778 10.04842322 -10.07785745 9.49136922 V 21.20384132 25.29224623 22.23214964 -19.98343120 21.29618878 3.25135952 V 23.87716999 24.07781712 20.85444624 4.19360198 0.91042670 -10.76860927 V 25.49188881 25.56482696 20.84620060 3.45828389 1.24300952 -2.22118401 V 25.51821382 23.70575425 22.75423936 18.59642621 10.77998183 -5.77981621 V 24.15586213 25.40395547 22.33226600 4.28035438 9.13273569 4.08001006 V 20.73049600 21.12036030 23.95631248 -6.54712136 -6.90605922 8.34008575 V 22.74843919 22.64432661 23.76023492 -13.20987076 -6.75475644 5.88366440 V 22.74849743 21.25911890 25.69019325 -2.63399004 -8.96016452 3.73671525 V 21.19877714 22.36227831 25.63250256 -4.86247124 1.55836753 3.04425399 V 23.86803601 21.05442580 23.85431870 0.30940470 -11.00049955 1.53766379 V 25.28011711 22.63572127 24.05791531 12.07784769 -6.31654276 10.81536089 V 25.23387496 21.08501927 25.56603388 3.54006481 -2.89309163 2.97368959 V 23.78409043 22.66501753 25.72580078 3.46532611 5.34639196 8.53619905 V 20.92866320 24.18883157 23.73970766 -11.40421468 -2.95615312 5.83201809 V 22.47512860 25.44832183 24.25980354 1.39598525 12.40471610 -6.53372507 V 22.29410360 24.27143892 25.40295338 -1.36874707 -6.91183753 12.25216650 V 21.10338854 25.74759167 25.61018303 -5.63613551 4.78854906 4.34533090 V 23.72064479 23.74663523 23.69643110 1.28689969 15.21520000 7.27119663 V 25.44857885 25.68843096 24.17061300 5.74726254 3.51365100 -2.58312935 V 25.79169807 24.08756944 25.44630638 2.90023759 -0.28997753 3.81939587 V 24.03851086 25.64982991 25.24795387 1.25345508 3.62961574 6.25823222