Tobermorite
Merlino S, Bonaccorsi E, Armbruster T
American Mineralogist 84 (1999) 1613-1621
Tobermorites: Their real structure and order-disorder (OD) character
Sample: 9 Angstrom
_database_code_amcsd 0002329
11.156 7.303 9.566 101.08 92.83 89.98 C-1
atom     x      y      z  Uiso
Si1  .3859  .2158  .2234  .013
Si2  .3181 -.0193  .4343  .025
Si3  .3883  .6416  .2173  .015
O1    .390   .150   .377  .030
O11   .390  -.209   .371  .024
O2    .499   .663   .121  .024
O21   .502   .152   .136  .018
O3    .268   .649   .118  .013
O31   .267   .163   .133  .018
O4    .403   .441   .277  .022
O6    .179  -.040   .384  .041
OH6   .152   .488   .390  .050
Ca1  .3713  .0981 -.1040  .017
Ca2   .499   .460   .502  .035
Ca3  .3647  .5966 -.1175  .017