NaNi2S2O10H3
Krickl R, Wildner M
European Journal of Mineralogy 19 (2007) 805-816
Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the
shortest known hydrogen bonds among mineral-type compounds
Part I: single-crystal X-ray structures
Sample: T = 293 K
_database_code_amcsd 0007248
8.605 6.185 7.336 90 114.78 90 C2/m
atom       x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na         0     .5     .5     .0247  .0149  .0372  .0224      0  .0081      0
Ni       .25    .25      0     .0079  .0072  .0067  .0099  .0002  .0037 -.0002
S     .09180      0 .29111     .0070  .0059  .0077  .0071      0  .0025      0
O1    .18889      0 .15953     .0107  .0126  .0096  .0143      0  .0099      0
O2    .21735      0 .49802     .0138  .0115  .0177  .0078      0 -.0001      0
O3   -.01593 .19671 .24532     .0103  .0083  .0087  .0127  .0019  .0032 -.0001
Oh    .15451     .5 .08712     .0087  .0076  .0082  .0110      0  .0046      0
H1      .060     .5   .034  .5  .017
H2      .188     .5   .195      .048