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=408.9479031367463 stress="-0.10959603826852707 -0.008689080317521539 -0.00405012332673206 -0.008689080317521539 -0.07318844338643977 -0.015969696880758118 -0.00405012332673206 -0.015969696880758118 -0.0900831720323797" pbc="F F F" C 10.35540510 10.46314185 10.61044915 -51.18712901 -27.39372353 -39.97758449 C 11.45960170 11.06143450 11.06401058 -94.59012180 86.67304697 -36.02254535 C 11.78829595 10.33509776 10.64041416 56.67801581 -167.34246800 -124.06163579 C 12.52812781 11.33208812 11.07834452 152.12160632 10.33979548 -19.84512196 C 10.37679405 11.89640262 10.70259391 -90.06078968 -2.48217378 -46.18630698 C 11.31504129 12.45865944 11.11550211 -278.89523294 216.49857523 128.38187414 C 11.78802619 12.22277084 10.68584377 229.83137165 -56.27293615 -303.94801037 C 12.71209668 12.94033349 11.23811829 53.02186701 41.93750985 -5.57845306 C 10.76959405 10.67626233 11.85402479 -135.49749754 -61.82319589 55.88176600 C 11.30137041 11.05875267 12.90300231 -6.41023882 -3.15934664 81.35529961 C 11.95834710 10.45774659 11.91852158 24.55655654 -102.46155805 33.30522330 C 12.70789336 10.88222229 12.52041603 100.40284733 20.28252873 76.00497437 C 10.69178619 12.26969424 12.56360834 -203.52104551 -88.58197804 -36.92261485 C 11.29836685 12.78253581 12.89904689 70.59031446 132.50136180 118.73653467 C 11.78091226 12.23742213 11.96603997 89.09819613 -30.07241601 88.87863347 C 12.55598025 12.83136267 12.76361598 83.86128006 31.35697804 29.99796729