Stannite
Bonazzi P, Bindi L, Bernardini G P, Menchetti S
The Canadian Mineralogist 41 (2003) 639-647
A model for the mechanism of incorporation of Cu, Fe and Zn in the
stannite - kesterite series, Cu2FeSnS4 - Cu2ZnSnS4
Sample: Fe080
_database_code_amcsd 0005839
5.446 5.446 10.757 90 90 90 I-42m
atom        x      y      z occ   Uiso
Cu(4d)      0    1/2    1/4 .96 .01865
Zn(4d)      0    1/2    1/4 .03 .01865
Fe(4d)      0    1/2    1/4 .01 .01865
Fe(2a)      0      0      0 .78 .01227
Zn(2a)      0      0      0 .14 .01227
Cu(2a)      0      0      0 .08 .01227
Sn(2b)      0      0    1/2     .00987
S(8i)  .75528 .75528 .87028     .01100