16 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=244.75665158488755 stress="-0.01554294624802522 -0.005004370360819122 -0.004071370606092067 -0.005004370360819122 -0.013635318018468321 -0.003913032001251469 -0.004071370606092067 -0.003913032001251469 -0.016044413013845613" pbc="F F F" No 20.75608599 20.81474701 20.97233984 -2.71286928 -5.28967359 -3.26018739 No 22.26545159 22.74660733 22.45309776 79.36353831 -113.89842160 18.99270865 No 24.07115576 21.01730969 21.04437410 -86.13471333 -83.36540490 -56.77912254 No 25.59179895 22.37690477 21.97565186 96.40203343 71.56247724 56.00988715 No 21.11983088 23.74180662 20.76099443 -70.13878430 46.64714262 -84.28820555 No 22.68343638 25.58891684 22.38333163 -76.38064083 111.83500395 -54.87728992 No 23.74266944 24.02714681 20.83357454 19.34464049 -22.80022990 -67.80334949 No 25.24177082 25.25925035 22.37769193 145.29720328 95.35271227 -91.70313877 No 20.99875128 21.13441246 24.00392623 -20.81873107 -20.80996291 3.77828394 No 22.50839513 22.43576728 25.72046910 -22.69026050 22.65973821 41.21667384 No 23.92925415 21.12869986 24.23330026 -123.72126306 -179.70658403 -149.22772376 No 25.22280994 22.44117850 25.31364778 163.79290943 148.21988191 130.64952514 No 21.20750062 24.19706883 23.89150839 -175.39258618 -62.02905836 -79.36212139 No 22.26531032 25.30954842 25.41330234 87.98408363 124.06200376 168.24464674 No 23.88419617 24.25684340 23.78372877 -20.42039475 -137.82294108 161.24081977 No 25.63375621 25.67645601 25.30033235 6.22583475 5.38331640 7.16859358