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=45.5471452089 stress="-10.685805921229584 2.086085046663602 -0.4498138953121008 2.086085046663602 -11.754498608360592 0.08168602753553277 -0.4498138953121008 0.08168602753553277 -10.25154737275666" pbc="F F F"
C      -0.12320595      -0.04105180       0.20259391     -20.35608423     -14.93532175     -13.49043457 
C       1.56504129       1.20865944      -0.13449789      15.73193210      11.72136957     -19.31787880 
C       1.28802619       0.22277084       1.68584377      26.36598618     -28.90367592      22.59159069 
C       0.18362810       1.69581920       1.64685009     -21.74183404      32.11762811      10.21672268