American Mineralogist Crystal Structure Database

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Bakerite
Download hom/bakerite.pdf
Perchiazzi N, Gualtieri A F, Merlino S, Kampf A R
American Mineralogist 89 (2004) 767-776
The atomic structure of bakerite and its relationship to datolite
Sample: Combined refinement
_database_code_amcsd 0003545
4.80042 7.57864 9.5426 90 90.435 90 P2_1/c
atom      x      y      z occ  Uiso
Ca   .99295 .10749 .33320     .0129
SiT1  .4754 .26337 .08782 .75 .0114
BT1   .4754 .26337 .08782 .25 .0114
BT2   .5623 .41009 .33929      .014
O1    .2566  .4032 .03594      .011
O2    .6685  .3032 .45842      .009
O3    .6854  .3277 .21010      .008
O4    .3146  .0909 .14570      .012
O5    .2557  .4065 .33656      .016
H1    .1877  .4614  .4290      .031
H2    .4265  .4772  .0387 .25  .031
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