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50-2_2_171126   Dupes   Run TOTOPOL


Structure Data
Name50-2_2_171126
Type Coden/a
Spacegroup 50
  P b a n
Energy (eV/TO2) 0.02
FD (T/1000 Å3) 17.987
UC volume 3) 889.515
avg. TD10 884
Lattice Parameters
a 8.823
b 14.395
c 7.004
α 90.000
β 90.000
γ 90.000
Topological Data
CS and VS
CS T1 1 4 11 22 37 58 82 112 147 184 227 272 324 382 443 510
VS T1 4.6_{2}.6.6_{2}.6.6_{2}
CS T2 1 4 10 21 38 59 83 112 144 181 227 276 327 382 440 504
VS T2 4.4.6_{3}.8_{3}.6_{3}.8_{3}
Topological Spheres data
Di Df Dsf
4.96 3.59 2.42
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CIF file