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50-2_2_159555   Dupes   Run TOTOPOL


Structure Data
Name50-2_2_159555
Type Coden/a
Spacegroup 50
  P b a n
Energy (eV/TO2) 0.01
FD (T/1000 Å3) 17.477
UC volume 3) 915.492
avg. TD10 933
Lattice Parameters
a 18.044
b 7.166
c 7.080
α 90.000
β 90.000
γ 90.000
Topological Data
CS and VS
CS T1 1 4 11 21 39 60 89 118 153 195 240 293 341 403 474 539
VS T1 4.5_{2}.5.8_{3}.5.8_{3}
CS T2 1 4 10 23 41 60 87 121 154 192 240 292 348 407 465 536
VS T2 4.4.6_{2}.8_{2}.6_{2}.8_{2}
Topological Spheres data
Di Df Dsf
5.10 3.65 2.83
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CIF file