4 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=-15.945648929818201 stress="0.8013919842683653 0.5867179619524598 -0.010371419342152736 0.5867179619524598 0.8742385475661436 -0.11779930750567195 -0.010371419342152736 -0.11779930750567195 0.5766595130303981" pbc="T T F" C -0.29134056 -0.13449789 0.22277084 -9.66861183 -10.52544099 7.24677495 C 1.68584377 1.68362810 0.19581920 10.63463638 8.64134801 4.18957905 C 1.64685009 0.26959405 1.67626233 9.73350606 5.54858531 -5.10731419 C -0.14597521 1.66771000 1.49207130 -10.69953061 -3.66449233 -6.32903981