Tobermorite
Merlino S, Bonaccorsi E, Armbruster T
American Mineralogist 84 (1999) 1613-1621
Tobermorites: Their real structure and order-disorder (OD) character
Sample: 11 Angstrom
_database_code_amcsd 0002330
6.735 7.385 22.487 90 90 123.25 Bm
atom     x     y      z  Uiso
Si1  .7581 .3862 .15738 .0054
Si2  .9087 .7531 .07116 .0086
Si3  .7592 .9697 .15773 .0056
O1    .771 .5059  .0942  .014
O2    .759  .178  .1327 .0127
O3    .985 .5369  .1982 .0090
O4    .519 .3063  .1942  .012
O5    .894  .746      0  .017
OH6   .188  .893  .0940  .018
Wat6  .270  .434  .0939  .045
O7    .770  .860  .0951  .015
O8    .523 .8110  .1951  .011
O9    .987 .0459  .1985  .010
Ca1  .2651 .4328 .20557 .0085
Ca3  .7499 .9228 .29348 .0074
Wat1  .427  .219      0   .14
Wat2  .879  .237      0  .061
Wat3  .422  .800      0   .13