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:Z:I:1:forces:R:3 energy=8583.695630870925 pbc="F F F"
Tl       0.00558478      -0.09801016      -0.13840951       81    -735.58914683    -234.44143542    -711.93850573 
Tl       1.27033083       1.79988862       0.15386102       81    4835.32500276   -4708.59875722    -849.79726564 
Tl       1.27775485       0.25193353       1.10277948       81    1859.20439234   -2035.50781551     379.48220160 
Tl       0.21886222       1.45493360       1.74623358       81   -2140.33665745    3294.27351737   -2162.29770617 
Tl       3.13442038       0.04421150      -0.00850828       81    -439.93972853    -488.71871295    -346.73421137 
Tl       4.35090169       1.46791096       0.25438590       81    2194.26956399   -2251.77549028   -2750.34474609 
Tl       4.29132951       0.22594895       1.62405492       81     428.95766147   -4479.38026842   -2897.72213320 
Tl       3.28303843       1.66462852       1.64786306       81   -2560.58272225     406.69397750    1620.34317424 
Tl       0.16069738       2.86198412      -0.15085460       81   -5065.17365495    4688.22292681   -1448.68360488 
Tl       1.40005146       4.55657197       0.24203315       81    -535.67089762       9.45231354    -919.62263971 
Tl       1.51031401       2.70106553       1.63518463       81     887.60275564    1824.74436539    1146.20816347 
Tl       0.08050946       4.65741128       1.68717787       81    -401.15691518     341.20603575    -220.55208685 
Tl       3.13871655       2.70321405       0.21529671       81   -2118.73607048    1963.91060676   -1722.53225778 
Tl       4.57765413       4.21796708       0.06859701       81      85.01594669    1091.78019212    -881.33035094 
Tl       4.64639943       2.85932396       1.21303126       81    1754.39201077    1248.77457153    2381.63420816 
Tl       2.80664277       4.70416829       1.36426596       81     767.50096959     149.25888669     656.86960216 
Tl      -0.02340713       0.26210346       2.83760897       81   -1243.79018619   -3241.46501812    2590.85821399 
Tl       1.56840637       1.24370729       2.98776489       81   -1596.03187105    1713.89241403    -574.95475615 
Tl       1.48348167      -0.18478068       4.33138732       81    -694.79016520    -514.60802546     892.25579605 
Tl       0.26778309       1.88330316       4.45749938       81    -713.05795959    -586.52064333     199.33020966 
Tl       2.85881109       0.19146693       3.20219224       81    2486.72790061   -2198.81862453    -385.93835740 
Tl       4.51967675       1.20003888       2.89637299       81    1527.06091801    3216.41280374    3126.95039170 
Tl       4.64066001       0.32468648       4.45037703       81     161.20069410    -602.15554561    1102.90462908 
Tl       2.71253156       1.74977446       4.29370076       81     981.52828323    -611.79011492    1177.80737002 
Tl      -0.25571705       3.09059021       2.83702610       81    -407.90972849    -403.19430538     -76.31570725 
Tl       1.21275813       4.38231868       3.25791524       81    1261.98541309     554.94331759    -814.31940803 
Tl       1.59441985       3.14214586       4.59267506       81    -438.73060639     565.48095627     837.57799449 
Tl      -0.29563622       4.48548905       4.20367408       81   -1090.79403945     351.99329967     925.34649383 
Tl       3.19889231       3.25662380       3.27358116       81    -150.83313341   -1443.56478139   -3404.11629249 
Tl       4.43153045       4.78227445       2.96474268       81     256.35235932     255.19924264     -80.54348620 
Tl       4.32018367       3.00078059       4.76011793       81    2348.90422297   -1929.07078354     727.10527603 
Tl       3.15254029       4.20783739       4.63747562       81   -1502.90461151    4053.37089468    2483.06979139