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:Z:I:1:forces:R:3 energy=10478.743004717402 pbc="T T T" C -0.06528701 0.27503097 0.25658008 6 -21819.23640170 -58325.22960742 -45544.79521920 C 0.90523949 0.50113941 0.24501208 6 20846.54032840 37471.69666949 -49003.66315508 C 0.78895530 -0.02373054 0.93994676 6 -6217.13137182 -36901.61834927 48817.23304112 C 0.04843064 0.94854218 0.78963773 6 7189.82744512 57755.15128720 45731.22533315