16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2494.61555332096 stress="-11270.270764414225 -2906.1467884874314 -1513.7442345375966 -2906.1467884874314 -11187.055456240654 -5480.210644285715 -1513.7442345375966 -5480.210644285715 -10252.685408381476" pbc="F F F" Tm 0.25288467 0.00437710 0.18878776 -741.88210547 -867.47552934 -992.79553011 Tm 1.30417330 1.32680571 1.66899066 906.22602801 1064.49886347 265.39225756 Tm 3.09438508 -0.03997139 0.14454663 16.45699978 -195.16493563 -277.08291464 Tm 4.42138966 1.41657270 1.80303718 440.52473717 173.88843100 -84.65970706 Tm -0.23227779 3.22238183 -0.02804105 -507.56026630 -333.27951338 -418.27421943 Tm 1.35184127 4.45732044 1.24026616 -560.09777082 1855.61005662 830.78648963 Tm 2.76973525 3.08142938 0.27142029 1244.72870100 -1093.62758489 -1017.46094454 Tm 4.69405044 4.51884672 1.72695678 120.64914883 98.51240790 -189.01630627 Tm 0.11041402 -0.04204876 3.16779531 -910.72655183 -980.90318353 -69.39157421 Tm 1.25069596 1.29102911 4.69694539 366.14395374 415.49033595 772.42751236 Tm 2.91177915 -0.27091410 2.95262964 -19.39584742 -413.66393124 185.39342210 Tm 4.53406103 1.11989648 4.63316961 109.90903145 1.14111112 154.07988859 Tm 0.17013436 3.16832007 2.93733367 -869.36202209 -254.26499110 154.45804088 Tm 1.57928571 4.53278300 4.34951703 -414.18337207 1079.39401181 846.64286796 Tm 2.82297666 2.93338190 3.26102553 -1055.99704310 -2163.18288404 -1625.92214067 Tm 4.20713699 4.22770020 4.26280543 1874.56637911 1613.02733529 1465.42285785