American Mineralogist Crystal Structure Database

1 matching records for this search.

Parafiniukite
 
Pieczka A, Biagioni C, Golebiowska B, Jelen P, Pasero M, Sitarz M
 
Minerals 8 (2018) 485
Parafiniukite, Ca2Mn3(PO4)3Cl, a new member of the apatite supergroup from
the Szklary pegmatite, Lower Silesia, Poland: description and crystal structure
Locality: Szklary pegmatite, Lower Silesia, Poland
_database_code_amcsd 0020737
9.4900 9.4900 6.4777 90 90 120 P6_3/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)
Ca1     2/3   1/3 .0054 .625 .0082  .0053  .0053  .0139  .0027      0      0
Mn1     2/3   1/3 .0054  .37 .0082  .0053  .0053  .0139  .0027      0      0
Na1     2/3   1/3 .0054 .005 .0082  .0053  .0053  .0139  .0027      0      0
Ca2  .01767 .2645   .25  .36 .0206  .0208  .0335  .0168  .0206      0      0
Mn2  .01767 .2645   .25  .63 .0206  .0208  .0335  .0168  .0206      0      0
Mg2  .01767 .2645   .25  .01 .0206  .0208  .0335  .0168  .0206      0      0
P     .3752 .4034   .25      .0103  .0043  .0059  .0227  .0041      0      0
O1    .5008 .3465   .25      .0119   .011   .014   .015   .009      0      0
O2    .4621 .5920   .25      .0247   .009   .001   .064   .002      0      0
O3    .2629 .3424 .4403      .0199   .011   .029   .024   .014  .0016  -.004
OH1       0     0   .25  .41 .0132
Cl1       0     0   .25  .28 .0132
F1        0     0   .25  .11 .0132
Cl2       0     0  .186  .10 .0132
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