32
Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-100.556655375 stress="0.09491769873483724 0.023405438352774935 -0.046737177371681045 0.023405438352774935 -0.022815297414887924 -0.05889958786643633 -0.046737177371681045 -0.05889958786643633 -0.29716984169840516" pbc="F F F"
C      -0.14459490       0.11115480       0.11044915       2.77149239       1.76369986       0.71581204 
C       1.70960170       1.31143450      -0.16166483      -3.38967611       3.12049718      -2.86443946 
C       1.28829595      -0.16490224       1.64041416      -1.29094296      -1.98112402       0.58143231 
C      -0.18818039       1.51878885       1.35433388       0.17497165       1.92974140      -0.24281314 
C       2.60009055      -0.07729744       0.10842934       2.43895124      -0.85100026       2.11972077 
C       4.56504129       1.20865944      -0.13449789      -1.91125515      -1.64471079       1.64107100 
C       4.04362335       0.22277084       1.68584377      -0.40981750      -2.68897169      -4.80601293 
C       3.18362810       1.69581920       1.34863482      -0.48988886      -2.66517356      -1.67008589 
C       0.26959405       3.17626233      -0.14597521       0.33472561      -4.74065883       1.52670431 
C       1.70996341       4.26498101       0.15300231      -2.22568895       2.08086863      -2.71751822 
C       1.53848316       2.95774659       1.41852158      -4.84715956      -4.24576451      -0.84396477 
C      -0.04210664       4.38825682       1.15131790       0.67334653      -1.45622314       2.06638052 
C       3.19178619       3.17895518       0.29140871      -0.47577451       0.45302725     -17.55960870 
C       4.47592018       4.53253581       0.20740224      -0.04829953      -0.13375704       0.13854897 
C       4.28091226       3.10609294       1.46603997       9.55209213       0.47943399       1.90920819 
C       2.80598025       4.32157598       1.51361598       1.28309058       9.05373657       0.96553330 
C      -0.14801295      -0.02432459       3.06329927      -0.02521447       0.06425036      -0.52384238 
C       1.18391079       1.26040289       2.99451428      -0.33396854       1.71982965       1.21033022 
C       1.34126820      -0.15859300       4.31668137       3.85940674       1.87396615      -1.61842543 
C      -0.08013605       1.16398412       4.59073906       0.53377193      -1.03252970      -0.65249855 
C       3.27219963      -0.06618674       3.13132919      -2.52951444       0.60247152       5.86999063 
C       4.75978669       1.22592512       2.78504734       0.02322043       1.85471534       2.63978350 
C       4.68365717       0.20288723       4.58343331      -3.81080384       2.94673094      -1.65907916 
C       2.79585403       1.44809454       4.72094491       2.39673925       2.34458539      -4.04474767 
C       0.23171545       3.18190327       3.02253701      -0.49966610       0.34737235      -2.68572241 
C       1.71219253       4.42485375       3.12990665       0.26614855       1.85946511       2.37284517 
C       1.28220450       3.28278197       4.56210000       6.87324039      -5.04881197       1.67689147 
C       0.13362859       4.32702941       4.57034430      -2.71775474       2.32003674      -0.71420692 
C       3.04852473       3.05473499       2.61904027      -1.05815756      -4.43464128      14.46346133 
C       4.53746781       4.40480033       2.87513051      -0.59300028      -0.43332835       1.13193625 
C       4.29869006       3.11041876       4.26735611      -2.57361223      -5.47876786      -0.24317799 
C       3.11720683       4.24148635       4.59612800      -1.95100210       2.02103455       1.81649366