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12_2_20167   Dupes   Run TOTOPOL


Structure Data
Name12_2_20167
Type CodeYUG
Spacegroup 12
  C 2/m
Energy (eV/TO2) 0.52
FD (T/1000 Å3) 21.473
UC volume 3) 745.114
avg. TD10 936
Lattice Parameters
a 13.788
b 11.632
c 6.572
α 90.000
β 135.018
γ 90.000
Topological Data
CS and VS
CS T1 1 4 11 22 39 61 88 120 155 192 241 295 344 404 473 539
VS T1 4.5.5.5.8.8
CS T2 1 4 10 22 39 61 89 118 153 198 241 287 349 409 465 541
VS T2 4.4.5.8_{2}.5.8_{2}
Topological Spheres data
Di Df Dsf
n/a n/a n/a
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CIF file