Structure 1525366

1525365 << 1525366 >> 1525367
Original COD entry Download CIF Download DOT

Citation: Swinnea, J.S.; Steinfink, H.; Rendon-Diazmiron, L.E.; de la Vega, S.E. (1981). The crystal structure of a Mexican Axinite. American Mineralogist, 66, pp. 428-432.

Formula: Al1.996 B Ca2 Fe0.859 H O16 Si4

Chemical name: Fe0.859 Ca2 Al1.996 (O H) (B O4) (Si4 O11)

Cell parameters:

  • a = 7.1437 Å
  • b = 9.1898 Å
  • c = 8.9529 Å
  • α = 91.857°
  • β = 98.188°
  • γ = 77.359°

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: Al4 B2 Fe2 H2 O32 Si8 (Al2 B Fe H O16 Si4)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 10, 15, 31, 26, 68, 63, 156, 121
  • 2, 6, 7, 31, 44, 79, 81, 119, 157, 211
  • 2, 6, 8, 26, 29, 74, 73, 135, 127, 210
  • 2, 6, 9, 37, 46, 77, 76, 119, 163, 238
  • 2, 7, 10, 30, 32, 80, 86, 142, 146, 186
  • 2, 7, 10, 31, 34, 79, 87, 137, 149, 196
  • 2, 9, 14, 31, 34, 74, 95, 133, 163, 179
  • 2, 9, 14, 34, 39, 63, 85, 132, 166, 190
  • 2, 9, 15, 35, 39, 63, 82, 131, 162, 190
  • 2, 10, 15, 29, 37, 67, 78, 130, 151, 196
  • 2, 10, 15, 29, 39, 66, 83, 129, 149, 200
  • 3, 9, 10, 32, 34, 81, 88, 152, 155, 200
  • 3, 9, 10, 34, 34, 70, 71, 147, 161, 204
  • 3, 10, 15, 31, 26, 68, 63, 156, 121, 197
  • 3, 13, 16, 31, 28, 73, 65, 158, 128, 212
  • 3, 13, 16, 34, 37, 79, 90, 149, 171, 191
  • 3, 14, 18, 31, 44, 69, 95, 125, 174, 203
  • 4, 4, 19, 29, 52, 61, 90, 123, 171, 210
  • 4, 5, 18, 22, 60, 69, 110, 117, 163, 215
  • 4, 5, 19, 24, 61, 65, 104, 116, 173, 214
  • 4, 6, 19, 20, 46, 47, 117, 115, 187, 174
  • 4, 6, 24, 31, 56, 61, 92, 126, 187, 221
  • 5, 7, 22, 22, 52, 58, 126, 131, 175, 190
  • 7, 12, 25, 27, 49, 66, 114, 144, 156, 206
  • 8, 15, 23, 28, 49, 68, 119, 127, 169, 193
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