American Mineralogist Crystal Structure Database

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Lithiophorite
Download hom/lithiophorite.pdf
Post J E, Appleman D E
Download am/vol79/AM79_370.pdf
American Mineralogist 79 (1994) 370-374
Crystal structure refinement of lithiophorite
Note: U(1,2) for Mn/Al/Li/O2 have been altered to match symmetry constraints.
_database_code_amcsd 0001641
2.9247 2.9247 28.169 90 90 120 R-3m
atom   x   y     z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn     0   0     0           .0131  .0131  .0158 .00655      0      0
Al   1/3 2/3   1/6 .65       .0073  .0073  .0128 .00365      0      0
Li   1/3 2/3   1/6 .33       .0073  .0073  .0128 .00365      0      0
O1   2/3 1/3 .0343           .0224  .0224  .0182  .0112      0      0
O2   2/3 1/3 .1319           .0217  .0217  .0129 .01085      0      0
H    2/3 1/3  .099      .12
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