Nowackiite
Marumo F
Zeitschrift fur Kristallographie 124 (1967) 352-368
The crystal structure of nowackiite, Cu6Zn3As4S12
Locality: Lengenbach, Binnatal, Switzerland
_database_code_amcsd 0010640
13.440 13.440 9.17 90 90 120 R3
atom     x     y     z   occ Biso B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3)  B(2,3)
Cu   .0741 .2932 .9987 .6667  .89 .00167 .00087 .00315 .00033 -.00043 -.00083
Zn1  .0741 .2932 .9987 .3333  .89 .00167 .00087 .00315 .00033 -.00043 -.00083
Cu2  .3088 .2275 .9920 .6667  .72 .00089 .00112 .00252 .00020  .00030 -.00009
Zn2  .3088 .2275 .9920 .3333  .72 .00089 .00112 .00252 .00020  .00030 -.00009
Cu3  .3895 .5539 .0088 .6667 1.45 .00207 .00229 .00531 .00080  .00034  .00005
Zn3  .3895 .5539 .0088 .3333 1.45 .00207 .00229 .00531 .00080  .00034  .00005
As1  .5533 .1680 .0071        .84 .00128 .00145 .00252 .00042 -.00012 -.00019
As2      0     0 .9808        .52 .00122 .00122 .00074 .00061       0       0
S1   .3695 .1026 .0792        .91 .00165 .00175 .00299 .00103  .00022 -.00026
S2   .4380 .4150 .0708        .93 .00162 .00151 .00288 .00059  .00007 -.00008
S3   .1251 .1646 .0909       1.08 .00193 .00140 .00445 .00093  .00056  .00015
S4   .2036 .4750 .0961        .81 .00090 .00189 .00284 .00076  .00031  .00102