16 Lattice="21.0 0.0 0.0 0.0 21.0 0.0 0.0 0.0 21.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=544.3248452546351 stress="-0.14651752201580917 0.005295304053946738 -0.003372744867358147 0.005295304053946738 -0.12754349822677732 -0.01716612333203801 -0.003372744867358147 -0.01716612333203801 -0.15237515542023922" pbc="F F F" C 10.35540510 10.46314185 10.61044915 -60.45320631 -25.80889890 -46.78774936 C 11.45960170 11.06143450 11.08833517 -151.78069199 111.73582571 -129.00940133 C 11.78829595 10.33509776 10.64041416 64.48646769 -257.97895662 -168.19593776 C 12.52812781 11.24446427 11.07834452 210.34040251 1.73577313 -18.05153538 C 10.37679405 12.02224746 10.70259391 -151.06815111 11.46273599 -98.81650171 C 11.31504129 12.45865944 11.11550211 -339.10038835 275.46801356 77.94059300 C 11.78802619 12.16022526 10.68584377 302.84260544 -50.37484394 -397.37318407 C 12.71209668 12.94033349 11.23811829 73.24157424 55.87242054 -15.55031636 C 10.76959405 10.67626233 11.85402479 -159.62967401 -103.60497222 88.77011244 C 11.30137041 11.24207130 12.90300231 -5.36346411 -75.23275745 182.12977127 C 11.85516453 10.45774659 11.91852158 122.02545576 -221.47331853 94.23700317 C 12.70789336 11.05812077 12.52041603 99.16893232 4.38229869 81.49467090 C 10.69178619 11.92292065 12.29140871 -200.53620236 79.66837603 37.32505968 C 11.45529265 12.78253581 12.89904689 -72.01292367 98.41814950 170.17789789 C 11.78091226 12.37829256 11.96603997 116.88143660 52.14545478 85.81565546 C 12.55598025 12.57157598 12.76361598 150.95782735 43.58469972 55.89386217