Structure 9001590

9001589 << 9001590 >> 9001591
Original COD entry Download CIF Download DOT

Citation: Post, J. E.; Appleman, D. E. (1994). Crystal structure refinement of lithiophorite Note: U(1,2) for Mn/Al/Li/O2 have been altered to match symmetry constraints.. American Mineralogist, 79, pp. 370-374.

Formula: Al0.65 H2 Li0.33 Mn O4

Cell parameters:

  • a = 2.9247 Å
  • b = 2.9247 Å
  • c = 28.169 Å
  • α = 90°
  • β = 90°
  • γ = 120°

List type: interleaving

List: 2D

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 6

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

Dimensionality: 2

Formula: Al H2 Li O2 (Al H2 Li O2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 24, 60, 96, 132, 168, 204, 240, 276
  • 1, 12, 42, 78, 114, 150, 186, 222, 258, 294
  • 4, 24, 60, 96, 132, 168, 204, 240, 276, 312
  • 13, 42, 78, 114, 150, 186, 222, 258, 294, 330
span 1 {1 1 1}

CIF datablock 1, entity 2 of 6

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

Dimensionality: 2

Formula: Al H2 Li O2 (Al H2 Li O2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 24, 60, 96, 132, 168, 204, 240, 276
  • 1, 12, 42, 78, 114, 150, 186, 222, 258, 294
  • 4, 24, 60, 96, 132, 168, 204, 240, 276, 312
  • 13, 42, 78, 114, 150, 186, 222, 258, 294, 330
span 1 {1 1 1}

CIF datablock 2, entity 3 of 6

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

Dimensionality: 2

Formula: Al H2 Li O2 (Al H2 Li O2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 24, 60, 96, 132, 168, 204, 240, 276
  • 1, 12, 42, 78, 114, 150, 186, 222, 258, 294
  • 4, 24, 60, 96, 132, 168, 204, 240, 276, 312
  • 13, 42, 78, 114, 150, 186, 222, 258, 294, 330
span 1 {1 1 1}

CIF datablock 3, entity 4 of 6

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

Dimensionality: 2

Formula: Mn O2 (Mn O2)

Multiplicity: 1

Coordination sequences:

  • 3, 21, 39, 57, 75, 93, 111, 129, 147, 165
  • 12, 30, 48, 66, 84, 102, 120, 138, 156, 174
span 1 {1 1 1}

CIF datablock 4, entity 5 of 6

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

Dimensionality: 2

Formula: Mn O2 (Mn O2)

Multiplicity: 1

Coordination sequences:

  • 3, 21, 39, 57, 75, 93, 111, 129, 147, 165
  • 12, 30, 48, 66, 84, 102, 120, 138, 156, 174
span 1 {1 1 1}

CIF datablock 5, entity 6 of 6

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

Dimensionality: 2

Formula: Mn O2 (Mn O2)

Multiplicity: 1

Coordination sequences:

  • 3, 21, 39, 57, 75, 93, 111, 129, 147, 165
  • 12, 30, 48, 66, 84, 102, 120, 138, 156, 174
span 1 {1 1 1}