American Mineralogist Crystal Structure Database

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Whitmoreite
Download hom/whitmoreite.pdf
Moore P B, Kampf A R, Irving A J
Download am/vol59/AM59_900.pdf
American Mineralogist 59 (1974) 900-905
Whitmoreite, FeFe2(OH)2(H2O)4[PO4]2, a new species: Its description and atomic
arrangement
_database_code_amcsd 0000411
10.00 9.73 5.471 90 93.8 90 P2_1/c
atom     x     y    z occ Biso
Fe1      0     0    0 .59 1.9
Mn1      0     0    0 .27 1.9
Fe2  .4603 .1373 .341     2.7
P    .3027 .4256 .325      .7
O1    .393  .477 .124     1.6
O2    .359  .481 .579     2.1
O3    .158  .482 .275     2.5
O4    .304  .262 .317     2.9
OH    .556  .235 .076     1.6
Wat1  .134 -.102 .298     3.1
Wat2  .047  .183 .188     3.3
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