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=93390.25626845502 stress="-575595.3946690924 -33933.512517621355 -339664.15511195787 -33933.512517621355 -136191.6592478176 -42673.270618147835 -339664.15511195787 -42673.270618147835 -416698.67451085534" pbc="F F F" Pa 0.19643481 -0.29598834 0.20845097 -394520.82022756 -68029.04363585 -339652.16299762 Pa 1.74232612 1.45159208 0.09033038 52324.17695946 27388.07455377 -55752.55141339 Pa 1.41613914 -0.14385064 1.23537767 411639.39585914 -11421.84127122 344733.94955485 Pa 0.30257190 1.43396993 1.31553221 -69442.75259105 52062.81035329 50670.76485615