Structure 1530556

1530555 << 1530556 >> 1530557
Original COD entry Download CIF Download DOT

Citation: Peacor, D.R.; Rouse, R.C. (1988). Holdawayite, Mn6 (C O3)2 (O H)7 (Cl,O H), a structure containing anions in zeolite-like channels. American Mineralogist, 73, pp. 637-642.

Formula: C2 H7.15 Cl0.85 Mg0.42 Mn5.58 O13.15

Chemical name: (Mn5.58 Mg0.42) (C O3)2 (O H)7 (Cl0.85 (O H)0.15)

Cell parameters:

  • a = 23.437 Å
  • b = 3.3137 Å
  • c = 16.618 Å
  • α = 90°
  • β = 111.15°
  • γ = 90°

List type: interleaving

List: 1-3D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 5

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

Dimensionality: 3

Formula: C8 H28 Mg20 Mn24 O52 (C2 H7 Mg5 Mn6 O13)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 12, 24, 58, 82, 128, 162, 224, 271
  • 1, 3, 13, 26, 46, 69, 123, 158, 217, 267
  • 1, 3, 13, 28, 51, 76, 115, 156, 221, 262
  • 1, 3, 15, 25, 56, 75, 125, 170, 206, 261
  • 1, 4, 14, 24, 44, 66, 111, 150, 218, 270
  • 1, 4, 14, 28, 44, 68, 118, 159, 204, 250
  • 1, 5, 15, 29, 43, 69, 108, 145, 209, 259
  • 1, 6, 14, 26, 42, 80, 104, 164, 210, 271
  • 1, 6, 16, 26, 45, 72, 106, 155, 204, 253
  • 2, 6, 20, 38, 57, 103, 140, 194, 229, 285
  • 2, 8, 20, 40, 65, 86, 126, 182, 248, 324
  • 3, 6, 26, 46, 65, 96, 126, 179, 277, 334
  • 3, 7, 35, 49, 75, 101, 142, 193, 288, 355
  • 3, 9, 25, 41, 68, 104, 139, 201, 280, 345
  • 3, 12, 26, 44, 60, 100, 137, 186, 252, 344
  • 3, 13, 25, 48, 68, 109, 139, 205, 274, 358
  • 3, 13, 26, 41, 68, 87, 128, 187, 249, 323
  • 3, 13, 26, 51, 74, 97, 139, 195, 255, 363
  • 4, 12, 24, 58, 82, 128, 162, 224, 271, 299
  • 4, 13, 23, 50, 71, 101, 144, 213, 273, 374
  • 4, 13, 26, 46, 69, 123, 158, 217, 267, 308
  • 4, 13, 28, 51, 76, 115, 156, 221, 262, 348
  • 4, 15, 25, 56, 75, 125, 170, 206, 261, 355
  • 4, 17, 25, 57, 74, 107, 151, 218, 276, 357
  • 5, 12, 32, 49, 94, 123, 177, 222, 261, 319
  • 5, 13, 32, 52, 87, 118, 181, 216, 259, 328
  • 5, 14, 24, 44, 66, 111, 150, 218, 270, 354
  • 5, 14, 28, 44, 68, 118, 159, 204, 250, 300
  • 6, 15, 29, 43, 69, 108, 145, 209, 259, 365
  • 7, 13, 34, 47, 84, 117, 161, 218, 293, 355
  • 7, 14, 26, 42, 80, 104, 164, 210, 271, 346
  • 7, 16, 26, 45, 72, 106, 155, 204, 253, 317
  • 7, 16, 31, 50, 76, 110, 153, 206, 300, 349
span 1 {1 1 1}

CIF datablock 1, entity 2 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: Cl4 (Cl)

Multiplicity: 1

Coordination sequences:

  • 4, 4, 4, 4, 4, 4, 4, 4, 4, 4
span 1 {1 1 1}

CIF datablock 2, entity 3 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: Cl4 (Cl)

Multiplicity: 1

Coordination sequences:

  • 4, 4, 4, 4, 4, 4, 4, 4, 4, 4
span 1 {1 1 1}

CIF datablock 3, entity 4 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: Cl3 (Cl)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 4, 2, 4, 2, 4, 2, 4, 2
  • 3, 3, 3, 3, 3, 3, 3, 3, 3, 3
span 1 {1 1 1}

CIF datablock 4, entity 5 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: Cl3 (Cl)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 4, 2, 4, 2, 4, 2, 4, 2
  • 3, 3, 3, 3, 3, 3, 3, 3, 3, 3
span 1 {1 1 1}