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=-82.03700688285498 stress="-0.0006493981783374507 -0.0002856731973944849 0.00017388721641277058 -0.0002856731973944849 -0.0006118897061752799 0.000217136389101166 0.00017388721641277058 0.000217136389101166 -0.0006659257600373079" pbc="F F F" Nb 20.85419141 20.88867035 21.05968816 0.92746249 0.50771661 0.08544546 Nb 22.37719504 22.35857546 22.61041876 2.48071436 -0.67081741 -4.87306047 Nb 23.46981356 20.99964527 20.77426349 -1.10889786 0.50908328 0.46068934 Nb 25.48583582 22.40735315 22.48696609 1.98916525 -0.33326326 -2.07759977 Nb 20.94143542 23.73091505 21.09993779 -0.56434013 -1.20465862 -1.28953708 Nb 22.25559716 25.20178472 22.79874826 14.68251127 19.93655746 -17.57718612 Nb 23.60387469 23.76291384 20.79437252 0.06459427 -0.39175999 -0.94897325 Nb 25.27838016 25.02342064 22.39854989 1.79965349 1.85968146 -1.55352556 Nb 20.92001865 21.20070203 23.66855151 -3.39810894 -2.81365786 1.42570469 Nb 22.62671728 22.79184741 25.50801768 -0.48472677 -0.34606506 2.77899815 Nb 24.03104337 21.16673543 23.99532961 -4.90605720 -7.20575365 -3.79260201 Nb 25.40517537 21.99442536 25.20378934 6.57030734 3.46962790 5.92058244 Nb 21.24624097 24.14302402 23.85498893 -20.54005435 -15.15796588 16.48317381 Nb 22.45930160 25.49932090 25.34248281 1.56819254 1.97017321 2.66211922 Nb 24.05280714 23.83633033 23.84655491 1.96572128 1.08848722 2.95610265 Nb 25.27939601 25.50337954 25.23874481 -1.04613705 -1.21738542 -0.66033151