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=76.9275609509 stress="-22.324519820904364 1.2111173206960353 0.544425363848316 1.2111173206960353 -17.295624410631227 0.6423766834801987 0.544425363848316 0.6423766834801987 -22.65554229990381" pbc="F F F" Cl -0.25354363 -0.01806569 -0.07998135 -30.20927506 -28.93730995 -25.90081653 Cl 1.70070203 1.20342959 -0.09914834 34.49932115 27.24483951 -48.27746446 Cl 1.49793547 0.28187239 1.51001192 31.34300768 -39.52787571 48.83688334 Cl -0.01546661 1.60170120 1.37793365 -35.63305378 41.22034616 25.34139764