16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=7.952382152408467 stress="-0.0013101478313666437 -1.4113115437082907e-05 -6.3278797697851095e-06 -1.4113115437082907e-05 -0.0013470519596181976 -1.3042151370226823e-05 -6.3278797697851095e-06 -1.3042151370226823e-05 -0.001290150335679842" pbc="F F F" P 20.87503672 20.91986395 20.94466750 -1.44450256 -1.89497298 -1.45359813 P 22.59073906 22.77219963 22.43381326 -2.95700693 -5.10006029 -2.40018385 P 23.83475878 21.25978669 20.72592512 1.17871008 -3.24150340 -3.40286637 P 25.28504734 22.68365717 22.70288723 10.07404460 -2.57444717 -3.53500488 P 21.08343331 23.79585403 20.94809454 -5.06695822 2.45580883 -5.08301018 P 22.72094491 25.73171545 22.68190327 -3.09500113 8.13722832 -1.64586748 P 23.82183498 24.21219253 20.92485375 3.05100816 2.44504710 -8.60398589 P 25.62990665 25.28220450 22.68363364 4.72940581 4.62164001 -0.29529414 P 21.06210000 21.13362859 23.82496488 -3.28674220 -4.39914411 1.49311073 P 22.57034430 22.83039712 25.55473499 -3.16245751 -3.19094566 8.20126564 P 23.92562261 21.13661615 23.88933373 -0.25507758 -9.80312041 1.35591257 P 25.37719504 22.40039126 25.61041876 4.12706774 -1.08911287 3.96074800 P 20.76735611 23.83533445 23.74148635 -7.00253846 3.17216826 2.11841283 P 22.58611608 25.53369179 25.52598936 -3.11153449 4.84956170 3.77371178 P 23.72329650 23.96375436 23.90583543 3.26012746 3.56843909 3.55202729 P 25.25559716 25.20178472 25.79874826 2.96145524 2.04341357 1.96462207