Phillipsite-Ca
Rinaldi R, Pluth J J, Smith J V
Acta Crystallographica B30 (1974) 2426-2433
Zeolites of the phillipsite family. Refinement of the crystal structure of
phillipsite and harmotome
_database_code_amcsd 0009518
9.865 14.300 8.668 90 124.20 90 P2_1/m
atom     x     y     z  occ Biso  B(1,1)  B(2,2)  B(3,3)   B(1,2)   B(1,3)   B(2,3)
K    .8480   .25 .2076       2.4 .016524 .002323 .031131        0  .013933        0
Ca   .6080 .6262 .4401  .41 2.14 .006009 .004279 .009728  .000921  .001923 -.001609
Al1  .7362 .0248 .2805 .334 1.08
Si1  .7362 .0248 .2805 .666 1.08
Al2  .4206 .1409 .0019 .334 1.06
Si2  .4206 .1409 .0019 .666 1.06
Al3  .0604 .0078 .2844 .334 1.11
Si3  .0604 .0078 .2844 .666 1.11
Al4  .1204 .1396 .0421 .334 1.14
Si4  .1204 .1396 .0421 .666 1.14
O1   .1335 .0976 .2289      2.04
O2   .6445 .5766 .1878      1.94
O3   .6100 .1130 .1728      1.89
O4   .0254 .9154 .1494      1.85
O5   .8957 .0440 .2713      2.06
O6   .3022 .3738 .0783      2.32
O7   .7872 .4795 .4982       1.9
O8   .5814   .75 .0616      1.94
O9   .0665   .25 .0196      2.12
Wat1 .7551   .75 .4733       7.8 .031545 .011125 .013620        0  .012394        0
Wat2 .1552   .75 .4382       7.3 .036802 .005379 .019457        0  .005129        0
Wat3 .3208 .8525  .174       8.8 .019903 .017727 .030158 -.001714  .014104 -.002682
Wat4 .5085   .25 .4384      18.7 .016148 .069686 .013620        0  .009403        0
Wat5    .5    .5    .5      16.6 .018026 .029830 .085609  .006857  .034619  .026581