16 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=332.54054495 stress="-57.62664421910055 -1.3451369809753864 -1.7972962137651647 -1.3451369809753864 -60.74410180518202 -1.5834188892077425 -1.7972962137651647 -1.5834188892077425 -55.4180356881007" pbc="F F F" N -0.21495266 0.18365717 0.20288723 -69.39988697 -60.29191451 -33.92325628 N 0.83343331 0.54585403 0.59894620 -34.80746480 -67.25540350 -7.08543729 N 1.72094491 0.23171545 0.18190327 59.57100182 -94.95540542 -106.33163572 N 2.07183498 0.96012800 0.95672613 228.62887974 -33.57317907 -119.40162966 N 0.12990665 1.28220450 0.28278197 -79.73570337 81.92855502 -67.37632714 N 0.81210000 2.38362859 0.58704133 -24.22060808 57.12734171 -2.72497168 N 1.57034430 1.54852473 0.05473499 12.00705365 30.33109246 -123.35251805 N 2.16561068 2.38661615 0.63933373 62.38322462 76.18184583 -14.58658108 N -0.12280496 -0.20130994 1.71211997 -70.05548424 -103.28054449 -4.31383108 N 0.39528976 0.58533445 1.99148635 39.93612097 2.17744079 98.88860176 N 1.58611608 0.03369179 1.52598936 19.37654364 -164.95359943 28.77883497 N 1.97329650 0.71375436 2.15583543 93.05223102 -24.03627094 182.52901801 N -0.24440284 1.20178472 1.51779212 -101.88098097 60.12044701 -9.94255374 N 0.52373573 2.13090187 2.11136659 -26.77292324 50.73956373 51.86422301 N 1.55835534 1.24645637 1.48193431 -123.57704586 163.05159212 91.66418765 N 2.02500758 2.45070203 1.95342959 15.49504207 26.68843870 35.31387631