Edingtonite
Gatta G D, Ballaran T B, Comodi P, Zanazzi P F
American Mineralogist 89 (2004) 633-639
Isothermal equation of state and compressional behavior of tetragonal edingtonite
Sample at P = 2.285 GPa
_database_code_amcsd 0003531
9.4669 9.4669 6.4765 90 90 90 P-42_1m
atom       x      y      z occ   Uiso
Ba1       .5     .0 .64407 .84  .0156
Ba2       .5     .0   .599 .04   .035
SiT1      .0     .0     .0 .60  .0185
AlT1      .0     .0     .0 .40  .0185
SiT2 -.17650 .08882 .38125 .61 .01860
AlT2 -.17650 .08882 .38125 .39 .01860
O1    .16745 .33255  .6277      .0179
O23  -.05014 .19435  .4589      .0229
O45  -.14302 .03088  .1435      .0242
Wat1   .1793  .3206  .1552 .74  .0160
Wat2   .3774  .1225 -.0136 .92  .0499