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=37.86870791977818 stress="-0.3975512074566317 0.039934481219210706 -0.010059940830481926 0.039934481219210706 -0.04224715383632846 -0.03017217994942244 -0.010059940830481926 -0.03017217994942244 -0.32737264555974377" free_energy=37.86870791977818 pbc="F F F"
F       0.02184289       0.15019543       0.13350600      -5.44064409      -3.00303290      -5.54993584 
H       1.81505645       1.78264486       0.15005014       2.03221734      -4.22298529       0.72877614 
C       1.53310309       0.23956773       1.22557373      23.03489624       4.25180308     -18.61729525 
C       0.14408857       1.47537525       1.70902946       3.33954040      10.63023687      -5.64849662 
C       2.65857048       0.16265408       0.04052745      -4.71897800       5.38703918       9.30804458 
H       4.01720862       1.66896007       0.14694176      -0.59297663      -1.19258558      -0.40765117 
H       4.38346043       0.27286036       1.21942634      -0.25784126      -0.23562035      -0.51880127 
H       2.72340307       1.53842820       1.53927611      -3.72345946      -2.64092211      -2.13398766 
F       0.23300259       3.30656806       0.26641046       0.12852152      -3.23101523       1.67411908 
F       1.50690460       4.75591686       0.41025294       1.59324880       1.19547711      -0.15566158 
C       1.53203659       2.96864501       1.76147517      -1.81863077     -13.30398344       7.17035315 
H       0.13723143       4.40894619       1.37818505      -1.12217852       1.14647110       1.25120190 
H       3.08550457       3.31609821       0.41951043      -0.94632032      -0.65598033      -1.71856602 
H       4.51560621       4.52357997       0.24727003       0.48932076       0.59655544      -0.72633348 
F       4.32128623       3.13856038       1.49965461      19.28685204     -20.99006999      -5.66782577 
F       3.27820060       4.28858747       1.67621204      -6.05117163      25.59689948      -7.47117763 
F       0.13215382       0.03922890       2.87689326     -22.71805164     -11.35410813       6.12061335 
H       1.61719846       1.77680686       3.21191582      14.47836748      13.78398172       0.17538298 
C       1.49640474       0.06224969       4.34915582      11.14874564       1.79449734      13.38244533 
F       0.31959787       1.23944939       4.51619234      -3.38067266      -8.64150914       4.12932073 
H       2.75814528       0.08475259       2.66448356      -1.44672453      -0.30235252      -1.01794410 
F       4.21647147       1.57493195       2.85978523     -12.11302294      12.72711116       4.34738958 
F       4.61644029       0.39112355       4.78081566      -1.03419312       0.01781076       0.67985243 
C       2.78561866       1.57730756       4.58177926       5.88113297      10.49243683     -15.20283981 
C       0.01400128       3.28219816       3.12659488     -20.92598950       5.62845767     -14.55237918 
F       1.54311643       4.24650446       3.13311255      11.31264062       1.67472343      -7.38214144 
F       1.50743936       2.80175050       4.57094765      16.04388649     -14.81674161      15.74786490 
C       0.15075815       4.26410200       4.46545771     -20.58366143      11.14924307       9.13835195 
C       2.84107598       3.10260142       3.18947213      -6.97067231     -13.00115207       6.70751195 
C       4.35847550       4.63185401       2.97839446     -10.85610407      -5.86680241      11.79942409 
H       4.33058461       2.82124654       4.52278034      -3.48528954       0.88539350      -2.96412553 
C       3.18407183       4.56109240       4.20032005      19.41721213      -3.49927662      -2.62548979