American Mineralogist Crystal Structure Database

1 matching records for this search.

Jankovicite
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Libowitzky E, Giester G, Tillmanns E
 
European Journal of Mineralogy 7 (1995) 479-487
The crystal structure of jankovicite, Tl5Sb9(As,Sb)4S22
_database_code_amcsd 0006589
7.393 8.711 17.58 103.81 91.81 109.51 P-1
atom     x     y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Tl1  .3120 .2507 .3768     .0369  .0240  .0338  .0453  .0047  .0018  .0046
Tl2  .7621 .3538 .8118     .0479  .0336  .0505  .0462  .0067 -.0055  .0008
Tl3  .2085 .0696 .0266  .5 .0381  .0289  .0337   .044  .0051  .0011  .0046
Sb1  .2986 .0734 .0177  .5 .0259   .017   .028   .025  .0020 -.0016  .0016
Sb2  .7111 .2253 .1907     .0247  .0255  .0237  .0220  .0066  .0017  .0041
Sb3  .5861 .2099 .5903     .0239  .0192  .0260  .0198  .0019 -.0015  .0028
Sb4  .2379 .1789 .7954     .0273  .0269  .0232  .0259  .0043 -.0012  .0026
Sb5  .8406 .2038 .4062     .0326  .0185  .0415  .0288  .0069 -.0003 -.0016
As1  .7423 .4474 .0262 4/5 .0261  .0232  .0225   .027  .0035 -.0007  .0030
Sb1  .7423 .4474 .0262 1/5 .0261  .0232  .0225   .027  .0035 -.0007  .0030
As2  .1321 .3286 .6123 2/3 .0253  .0234  .0218  .0256  .0042 -.0010  .0028
Sb2  .1321 .3286 .6123 1/3 .0253  .0234  .0218  .0256  .0042 -.0010  .0028
S1   .9892 .1432 .6890     .0258   .019   .028   .023  .0003  -.003  .0043
S2   .2753 .0380 .5113     .0234   .017   .024   .022  .0018  -.002  .0016
S3   .9685 .1033 .2018     .0271   .021   .022   .034  .0039   .001  .0053
S4   .9157 .3190 .0857     .0250   .023   .029   .021   .007   .002  .0053
S5   .4459 .4257 .6738     .0241   .019   .023   .024  .0026   .001  .0010
S6   .0738 .2732 .9087     .0282   .033   .023   .023   .005   .001  .0016
S7   .5112 .5970 .9038     .0448   .031   .050   .053   .013   .013   .014
S8   .5105 .0670 .9087     .0386   .035   .038   .024  -.008  -.004   .003
S9   .5592 .0395 .3113     .0247   .022   .027   .017   .002  -.000  .0015
S10  .9681 .4545 .3210     .0242   .022   .022   .022  .0035  -.001  .0007
S11  .3007 .6122 .5072     .0241   .023   .025   .018  .0034   .003  .0013
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