Simonkolleite
Hawthorne F C, Sokolova E V
The Canadian Mineralogist 40 (2002) 939-946
Simonkolleite, Zn5(OH)8Cl2(H2O), a decorated interrupted-sheet structure
of the form [M_2]4
_database_code_amcsd 0005776
6.3412 6.3412 23.646 90 90 120 R-3m
atom       x     y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Zn(1)     .5     0      0     .0122  .0099  .0085  .0177  .0042  .0002  .0004
Zn(2)      0     0 .07172     .0124  .0114  .0114  .0145  .0057      0      0
Cl         0     0 .16948     .0253  .0311  .0311  .0137  .0156      0      0
Oh(1)  .8288 .1712 .04988     .0125  .0128  .0128  .0133  .0073 -.0003  .0003
Oh(2)      0     0  .3741     .0117  .0117  .0117  .0115  .0059      0      0
Wat(3)  .969  .031   .502 1/6 .0369
H(1)    .786  .214   .086       .05
H(2)       0     0  .4155       .05