32
Lattice="7.976530075073242 0.0 0.0 0.0 7.976530075073242 0.0 0.0 0.0 7.976530075073242" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-22.532151007623398 pbc="F F F"
Tl       0.17544850      -0.20348473      -0.06078850       81      -1.19938620      -0.90048824       0.80412920 
Tl       2.14278005       1.63240449      -0.18395324       81      -0.94324769       6.76632665       0.04058069 
Tl       2.29935265      -0.06442623       1.92646010       81      -3.67386654      -4.40757483       0.44730927 
Tl       0.18827488       1.97456877       2.08173671       81     -22.59305789      -1.31153984     -21.25541704 
Tl       4.13047985      -0.08608785      -0.13519433       81       0.26536930      -3.51912521      -2.34932244 
Tl       6.01519986       1.85523389      -0.09357658       81       0.75924352       3.29751823      -0.26459699 
Tl       5.77587226       0.08240720       1.95557579       81      26.59455119     -26.38299542     -10.40962192 
Tl       4.18377493       1.75528304       2.24117687       81     -25.89257926      55.58871262     -35.93858728 
Tl       0.14978947       4.21153420       0.03607904       81     -21.09571296     -16.96752062     -17.21253828 
Tl       1.95582173       5.82956315      -0.00635666       81      12.21550176      16.35298763      -7.62248175 
Tl       1.80581592       4.07533105       1.81020178       81      15.37395983     -10.64955677      17.19686756 
Tl      -0.00905916       5.88264047       1.89631192       81      -5.54857589      10.73235648       7.72774008 
Tl       4.09939745       4.07931600       0.10839198       81     -12.23626124     -14.15639671       0.84012711 
Tl       5.83006520       5.75715742      -0.06432833       81      11.36211345      11.89496927      -1.09881763 
Tl       6.03582357       4.00761721       2.10396462       81      -0.02655868      -4.75961627      -3.51735655 
Tl       3.68111417       5.97478137       2.13088204       81       3.22496183       2.24160790       0.26820082 
Tl       0.12247778      -0.09379988       4.06436003       81      -0.68961791      -1.59654357      -0.64648432 
Tl       1.86090554       1.94774617       3.70137707       81      22.59395856       3.29380630      23.82796270 
Tl       2.20844008      -0.06232641       6.02209103       81      -5.44147813      -4.33780147      -0.69188225 
Tl       0.02533237       1.91642048       6.05111760       81       1.08539781       1.17612305      -0.62015668 
Tl       4.18876414       0.21212335       3.90689339       81     -16.26645477     -41.65496948      32.41257036 
Tl       6.06499811       1.78497147       3.87981143       81      17.77836980      14.90505439       7.25114570 
Tl       6.08853143       0.02997608       5.84601096       81       5.92283179      -6.18280568       3.04013412 
Tl       4.09780353       1.62288529       6.01581493       81      -0.21694625      14.91179423       5.12203736 
Tl      -0.09350958       4.16489965       4.08137507       81      -4.52437841     -22.12333116     -20.41549883 
Tl       1.76554960       6.10735173       4.14511527       81      28.06103961      11.13469899     -31.63076941 
Tl       2.18573829       4.19963156       5.82662096       81       0.57005466     -13.31752308       7.62709692 
Tl       0.21023350       5.74304341       5.78201799       81     -30.16046816      17.85790882      48.22409297 
Tl       4.10102749       4.20270626       4.16308145       81      -7.39374844     -12.57544552     -11.15197488 
Tl       6.07226665       5.72359620       4.01607373       81       7.53210949      16.74698568      -4.10062907 
Tl       6.15467539       3.90922158       5.73107634       81       3.54449469      -8.29082846       9.32111178 
Tl       4.18947933       5.92321978       6.06145061       81       1.01838112       6.23321210       4.77502868