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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.

Simonkolleite
Download hom/simonkolleite.pdf 
Hawthorne F C, Sokolova E V
Download cm/vol40/CM40_939.pdf 
The Canadian Mineralogist 40 (2002) 939-946
Simonkolleite, Zn5(OH)8Cl2(H2O), a decorated interrupted-sheet structure
of the form [M_2]4
_database_code_amcsd 0005776
6.3412 6.3412 23.646 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)
Zn(1)     .5     0      0     .0122  .0099  .0085  .0177  .0042  .0002  .0004
Zn(2)      0     0 .07172     .0124  .0114  .0114  .0145  .0057      0      0
Cl         0     0 .16948     .0253  .0311  .0311  .0137  .0156      0      0
Oh(1)  .8288 .1712 .04988     .0125  .0128  .0128  .0133  .0073 -.0003  .0003
Oh(2)      0     0  .3741     .0117  .0117  .0117  .0115  .0059      0      0
Wat(3)  .969  .031   .502 1/6 .0369
H(1)    .786  .214   .086       .05
H(2)       0     0  .4155       .05


  Download AMC data (View Text File)
  Download CIF data (View Text File)
  Download diffraction data (View Text File)
  View JMOL 3-D Structure (permalink)

	 

	

					
				
				
				
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