American Mineralogist Crystal Structure Database

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Partheite
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Lazic B, Armbruster T, Liebich B W, Perfler L
American Mineralogist 97 (2012) 1866-1873
Hydrogen-bond system and dehydration behavior of the natural zeolite partheite
Note: T = 275 C
Locality: Denezhkin Kamen, Urals Region, Russia
_database_code_amcsd 0019715
20.82 9.350 8.359 90 78.86 90 C2/c
atom     x      y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1  .3381  .1878 .0636 .0485   .064   .059   .029  -.004  -.023  -.003
Al1  .0925  .1123 .6391 .0452   .066   .047   .028  -.003  -.023   .000
Al2  .2041  .3130 .2866 .0419   .058   .044   .028   .001  -.018   .002
Si1  .0624  .2007 .2969 .0438   .058   .048   .032   .007  -.023  -.005
Si2  .2415  .0525 .4526 .0394   .060   .033   .032   .002  -.026  -.005
O1   .0697  .0570 .3036  .090   .122   .065   .096   .023  -.054  -.041
O2   .0539  .1847 .4903  .045   .063   .046   .030  -.003  -.015   .014
O3   .1291  .2954 .2252  .050   .058   .068   .029  -.004  -.024   .007
O4   .1760 -.0984 .0659  .055   .050   .050   .068  -.008  -.023   .012
O5   .1968  .4310 .4506  .043   .048   .049   .036  -.004  -.022  -.001
O6   .2525  .1574 .2924  .044   .066   .050   .025  -.005  -.026   .004
O7   .2539  .3842 .3906  .040   .056   .044   .025  -.006  -.023   .004
O8       0  .2869   .25  .037   .056   .024   .032   .000  -.013   .000
O9   .4178  .2720 .1886  .064   .077   .093   .026   .002  -.023  -.026
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