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=19.730314793834445 stress="-0.770609529824582 -0.45983993733570855 -0.11796687133470268 -0.45983993733570855 -0.907011535462117 0.4100042990814486 -0.11796687133470268 0.4100042990814486 -1.469687831696498" pbc="T T F" Na -0.13449789 -0.21197381 0.22277084 12.67608917 16.95154611 -14.98332586 Na 1.68584377 1.68362810 0.19581920 -16.07022305 -8.86419245 -14.44262954 Na 1.64685009 0.42259636 1.67626233 -8.44877673 -5.66661040 10.54307734 Na -0.14597521 1.70996341 1.49207130 11.84291062 -2.42074326 18.88287806