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=5501.973484952375 stress="-276.86142867745235 118.58146727651854 91.85460636802121 118.58146727651854 -1061.3139651138586 549.4682646451712 91.85460636802121 549.4682646451712 -1235.9232970058076" pbc="F T T"
At       0.50495673       0.03968825       0.05644429   -3740.91783685    -331.19365049   -2897.67626279 
At       1.70918583       1.75228033      -0.27305449    2789.56530026  -19515.12317374   18621.96199024 
At       1.75929501      -0.24299512       1.53093840    2879.45291021   16814.95654313  -19142.62599621 
At       0.24346887       1.34013982       1.22655653   -1928.10037362    3031.36028110    3418.34026875