Bideauxite
Cooper M A, Hawthorne F C, Merlino S, Pasero M, Perchiazzi N
The Canadian Mineralogist 37 (1999) 915-921
Stereoactive lone-pair behavior of Pb in the crystal structure of
bideauxite: Pb2AgCl3F(OH)
Sample MPP
_database_code_amcsd 0005625
14.1376 14.1376 14.1376 90 90 90 *Fd-3m
.125 .125 .125
atom      x      y      z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb   .22192 .22192 .22192      .0303  .0303  .0303 -.0040 -.0040 -.0040
Ag      1/2    1/2    1/2      .0446  .0446  .0446  .0110  .0110  .0110
Cl    .8375    1/8    1/8      .0444  .0317  .0317      0      0 -.0002
OH    .0539  .0539  .0539  .5  .0243  .0243  .0243 -.0005 -.0005 -.0005
F     .0539  .0539  .0539  .5  .0243  .0243  .0243 -.0005 -.0005 -.0005