American Mineralogist Crystal Structure Database

1 matching records for this search.

Parasibirksite
 
Sun W, Huang Y-X, Li Z, Pan Y, Mi J-X
 
The Canadian Mineralogist 49 (2011) 823-834
Hydrothermal synthesis and single-crystal X-ray structure refinement of
three borates: sibirskite, parasibirskite and priceite
Locality: synthetic
Note: T = 295 K
_database_code_amcsd 0018464
6.6994 5.4269 3.5534 90 93.048 90 P2_1/m
atom       x     y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca(1) .35260   .25 .24837            .0115  .0072  .0094      0 .00105      0
H(1)   -.030  .863   .974  .5 .0480
B(1)   .2251   .75  .7704            .0092  .0112  .0088      0 -.0002      0
O(1)   .0236   .75  .8724            .0115  .0293  .0322      0  .0074      0
O(2)   .3188 .5318  .7367            .0198  .0085  .0119 -.0002  .0026 -.0003
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