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=228.696754552 stress="-32.00450513453381 0.02083873764650471 -0.8798324861729451 0.02083873764650471 -27.4776709402459 -2.5036305140637123 -0.8798324861729451 -2.5036305140637123 -30.561835559758467" pbc="F F F" C -0.14459490 0.11115480 0.11044915 -41.23715801 -13.83780170 -26.52591043 C 0.95960170 0.56143450 0.58833517 -23.91611702 -14.85848245 -26.57701676 C 1.28829595 -0.16490224 0.14041416 14.74490672 -65.71339076 -66.72886096 C 2.02812781 0.62077590 0.57834452 87.98160091 7.92491873 -31.79118354 C -0.12320595 1.45894820 0.20259391 -58.79551052 11.89288408 -26.91102483 C 0.81504129 1.95865944 0.61550211 -49.58070445 78.15472020 -14.29073553 C 1.28802619 1.72277084 0.18584377 61.05593132 19.29771478 -87.69527085 C 2.43362810 2.44581920 0.87252551 26.00855440 16.44806027 -5.03492232 C 0.26959405 0.17626233 1.35402479 -56.00243701 -32.56874784 39.61608792 C 0.95996341 0.74207130 2.40300231 -19.39266226 -28.70896714 56.94262125 C 1.53848316 -0.04225341 1.41852158 28.36756278 -67.86640097 44.48082091 C 2.20789336 0.63825682 2.02041603 46.94428075 -9.19027667 30.66638382 C 0.19178619 1.74225445 1.79140871 -67.79496319 9.72490951 24.94597866 C 0.86455359 2.28253581 2.39904689 -13.71054248 48.89501163 46.70757046 C 1.28091226 1.60609294 1.46603997 23.25315898 16.47094267 18.27731860 C 2.05598025 2.07157598 2.26361598 42.07409908 23.93490566 23.91814359