Stibnite Kyono A, Kimata M American Mineralogist 89 (2004) 932-940 Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb1.935Bi.065S3 _database_code_amcsd 0003553 11.3122 3.8428 11.221 90 90 90 Pnma atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Sb1 .47149 .25 .32601 .964 1.406 .0207 .0148 .0180 0 -.0017 0 Bi1 .47149 .25 .32601 .036 1.406 .0207 .0148 .0180 0 -.0017 0 Sb2 .34992 .75 .03608 .972 1.728 .0190 .0216 .0251 0 .0043 0 Bi2 .34992 .75 .03608 .028 1.728 .0190 .0216 .0251 0 .0043 0 S1 .2918 .25 .1919 1.35 .0193 .0173 .0148 0 .0010 0 S2 .5496 .75 .1231 1.32 .0167 .0159 .0176 0 .0018 0 S3 .3751 .75 .4388 1.32 .0200 .0156 .0147 0 -.0018 0