16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-53.4823611557 pbc="F F F" Mo -0.08129564 0.04860922 0.20118821 42 0.36201091 0.36892988 2.18055156 Mo 1.98180132 1.31143450 1.33833517 42 -35.69260981 23.11913087 22.69781441 Mo 2.72210921 -0.03357304 0.40020085 42 11.73082838 -41.00021812 -30.35195207 Mo 4.27812781 1.24471398 1.32834452 42 18.33507807 7.06533855 2.22181069 Mo 0.06045122 3.16183542 0.28602722 42 -15.52163456 -11.80084549 -12.29735185 Mo 1.36089532 4.20865944 1.36550211 42 -1.38768459 27.42582542 19.68499415 Mo 2.78802619 3.17086538 0.40678868 42 20.18629418 -1.26302226 -18.83546279 Mo 4.50546308 4.62067295 1.64685009 42 -0.43063924 -0.78175303 3.19508936 Mo 0.39950070 -0.04153317 3.13680676 42 -1.23461016 0.09599517 -2.82647977 Mo 1.77206341 1.62569989 4.48003172 42 -3.79737341 -3.79038622 7.03883697 Mo 3.10882746 0.00627132 2.97325657 42 1.35067342 -6.64667583 6.17589914 Mo 4.37350405 1.38825682 4.40703218 42 1.98184485 1.87145476 0.97931664 Mo 0.09658652 3.05615023 3.09009877 42 -3.32508839 -2.13553674 1.05769036 Mo 1.72497236 4.29989192 4.48438134 42 -0.75818578 2.82298790 2.11562355 Mo 2.78091226 2.84757929 2.96603997 42 7.76108760 6.16156235 -0.54010355 Mo 4.39209633 4.35526777 4.53960534 42 0.44000853 -1.51278723 -2.49627679