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=-1.93001547283 stress="-1.3933475995529534 -1.151032781177332 1.0677775709157449 -1.151032781177332 4.4001304379987305 -0.15662878258391916 1.0677775709157449 -0.15662878258391916 3.8500806259529283" pbc="F F F"
C      -0.21495266       0.18365717       0.20288723      -3.18405719       5.83459464       6.11961744 
C       1.58343331       1.29585403      -0.05190546       5.73054432      -3.73156958       5.89884869 
C       1.50314941       0.23171545       1.68190327      -2.03359028       9.20582624      -8.48190992 
C       0.10461695       1.71219253       1.42485375      -0.51289685     -11.30885129      -3.53655621