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The RRUFF Project is being updated to improve its interface and content. The beta version of the update is accessible to the public at RRUFF.net. New data is only being added to the beta site. Please note that it is in development, and some components are not functional. Existing RRUFF.info links will resolve to the new site after RRUFF.net is officially released.

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American Mineralogist Crystal Structure Database

1 matching records for this search.

Paceite
Download hom/paceite.pdf 
Klop E A, Duisenberg A J M, Spek A L
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=39&spage=1342 
Acta Crystallographica C39 (1983) 1342-1344
Reinvestigation of the structure of calcium copper acetate hexahydrate,
CaCu(C2H3O2)4*6H2O
_database_code_amcsd 0009984
11.152 11.152 16.240 90 90 90 I4/m
atom     x      y     z occ  Uiso
Ca      .5      0    .5     .0308
Cu      .5      0   .25     .0264
C1   .6889 -.0876 .3375     .0339
C2   .8069 -.1468 .3550     .0535
O1   .6591 -.0744 .2626     .0376
O2   .6242 -.0545 .3942     .0616
Ow1  .5462  .3299 .3581     .0457
Ow2  .5779  .1951    .5      .057
H1A  .8591 -.0768 .3783  .5  .062
H1B  .8383 -.1452 .4107  .5  .062
H2A  .8367 -.1966 .3082  .5  .062
H2B  .8713 -.1057 .3080  .5  .062
H3A  .7814 -.2068 .4097  .5  .062
H3B  .7961 -.2413 .3295  .5  .062
H4    .555   .283  .324      .070
H5    .489   .352  .361      .070
H6    .567   .240  .458      .064


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	Total number of retrieved datasets: 1

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