32 Lattice="65.46255302429199 0.0 0.0 0.0 65.46255302429199 0.0 0.0 0.0 65.46255302429199" Properties=species:S:1:pos:R:3:forces:R:3 energy=-173.3425309854353 stress="-0.0011654940081962072 -6.024123444008839e-05 -5.509074580721913e-05 -6.024123444008839e-05 -0.0009678462681341535 0.0001268847271690904 -5.509074580721913e-05 0.0001268847271690904 -0.0011901652684918568" pbc="F F F" Sc 32.69136390 32.82803270 32.68181836 -4.58217325 -12.10871105 -6.56188777 Sc 34.85662294 35.03162705 32.77574335 19.58611214 -3.08424863 -13.91339439 Sc 35.29707348 32.75315229 35.22523509 -15.47492692 -8.03827499 -16.26116500 Sc 32.80427019 34.83058646 34.99256415 -11.40516941 9.38860665 12.75129069 Sc 37.17401882 32.51620753 32.63519683 2.49514415 2.33951401 -0.12521915 Sc 39.62174927 34.95375841 32.55621823 1.85624416 -1.98874421 -0.45099667 Sc 39.96337673 32.87194401 35.29347347 3.95215850 -2.01529039 -6.84672151 Sc 37.53840211 35.14454847 35.05691495 -12.94229158 -20.94711077 -9.45869004 Sc 32.56055030 37.16669849 32.94375557 -3.56259692 9.79106415 -3.60298369 Sc 35.28169551 39.73390391 32.60815554 -2.67365787 0.61053216 1.63764547 Sc 35.29128811 37.25303059 34.87416283 -26.37990863 14.16474469 14.91509393 Sc 32.76039637 39.68899891 35.26496503 2.30916532 -0.20257692 -2.42915298 Sc 37.36000759 37.26670770 32.77987269 13.35874945 4.29837454 -18.59394303 Sc 39.70140930 39.61255400 32.53649446 -0.83507648 -0.69495650 1.76429531 Sc 39.77487780 37.21109659 35.07757061 8.95200304 24.82085042 -16.27265050 Sc 37.50250621 39.96334043 35.20141246 -4.56995185 -3.36528314 -4.35972623 Sc 32.62396027 32.93288046 37.41723980 -4.99351532 -7.22086581 3.04317223 Sc 35.01216549 35.05092290 37.22971407 6.20032251 4.82350518 10.13357941 Sc 34.87567987 32.87005798 39.67888260 8.34857793 -3.39377490 1.93356096 Sc 32.85096058 35.29518787 39.79275892 -9.94032923 -8.19925914 7.74846937 Sc 37.48939880 32.63750033 37.21270983 7.85279217 0.25483657 18.79452868 Sc 39.54382902 35.31185520 37.29335808 14.53414387 -23.87199294 17.85954811 Sc 39.92658589 32.67420270 39.65225571 -1.78776826 2.48239660 -2.14393009 Sc 37.48148677 35.22174303 39.68454823 -7.30254122 -23.32466712 3.37364158 Sc 32.79469480 37.36698373 37.54230703 -3.88877082 2.27726631 -10.39364697 Sc 35.09439875 39.57844272 37.67284824 -10.36404311 11.02350556 -22.48423488 Sc 35.23009588 37.23695962 39.76898969 -8.98693588 4.41731234 8.20746812 Sc 32.84075847 39.78616469 39.80613809 -3.96925199 -0.29673727 5.01335659 Sc 37.19560720 37.34636607 37.27683202 11.43288079 6.36753231 2.52392866 Sc 39.68669906 39.92730923 37.48024903 3.87524364 -3.27351040 1.23719152 Sc 39.72487607 37.19288776 39.66386609 12.00119958 18.72201686 7.74972317 Sc 37.30642168 39.53802534 39.64610383 16.90417147 6.24394582 15.21184909