Structure 9015981

9015980 << 9015981 >> 9015982
Original COD entry Download CIF Download DOT

Citation: Rossell, H. J. (1982). Calzirtite - A fluorite-related superstructure. Acta Crystallographica, Section B, 38, pp. 593-595.

Formula: Ca O8 Ti Zr2.5

Cell parameters:

  • a = 15.2203 Å
  • b = 15.2203 Å
  • c = 10.1224 Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: O128 Ti32 Zr64 (O4 Ti Zr2)

Multiplicity: 1

Coordination sequences:

  • 2, 20, 38, 73, 123, 190, 308, 384, 505, 595
  • 4, 18, 38, 93, 151, 162, 288, 388, 527, 603
  • 4, 22, 40, 89, 131, 198, 303, 393, 530, 621
  • 6, 24, 35, 87, 130, 226, 305, 374, 509, 622
  • 6, 27, 38, 79, 150, 219, 328, 377, 501, 679
  • 10, 23, 64, 104, 150, 232, 306, 450, 526, 652
  • 11, 22, 55, 88, 150, 251, 307, 428, 521, 671
  • 11, 22, 64, 104, 150, 232, 306, 450, 526, 652
  • 12, 23, 52, 88, 154, 246, 342, 400, 506, 710
  • 13, 22, 52, 88, 154, 246, 342, 400, 506, 710
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