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=14.620600571563022 pbc="T F T" Cn 0.12322868 0.09407717 -0.18603921 112 -14.90650348 -17.80858354 -8.47028061 Cn 1.37873478 1.22219576 0.05775088 112 76.66633356 7.63056184 -59.55508928 Cn 1.50188089 -0.11520838 1.22255755 112 3.09035161 -9.52237826 8.06823414 Cn 0.23157572 1.45284428 1.03318714 112 -64.85018169 19.70039995 59.95713575