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142_2_301221   Dupes   Run TOTOPOL


Structure Data
Name142_2_301221
Type Coden/a
Spacegroup 142
  I 41/a c d:1
Energy (eV/TO2) 0.67
FD (T/1000 Å3) 33.333
UC volume 3) 1200.034
avg. TD10 1831
Lattice Parameters
a 6.222
b 6.222
c 30.994
α 90.000
β 90.000
γ 90.000
Topological Data
CS and VS
CS T1 1 4 12 31 62 103 158 226 306 405 513 623 746 879 1022 1183
VS T1 6.6.6.6.6.8_{8}
CS T2 1 4 12 32 60 104 156 234 328 416 520 636 758 896 1052 1192
VS T2 6.6.6.6.8_{12}.8_{12}
Topological Spheres data
Di Df Dsf
n/a n/a n/a
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CIF file