American Mineralogist Crystal Structure Database

2 matching records for this search.

Sarrabusite
 
Gemmi M, Campostrini I, Demartin F, Gorelik T E, Gamaccioli C M
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=68&spage=15
Acta Crystallographica B68 (2012) 15-23
Structure of the new mineral sarrabusite, Pb5CuCl4(SeO3)4,
solved by manual electron-diffraction tomography
Note: Manual data, this is the prefered structure
Locality: Baccu Locci mine, near Villaputzu, Sardinia, Italy
_database_code_amcsd 0018632
24.917 5.506 14.242 90 101.77 90 C2/c
atom      x     y     z  Uiso
Pb1   .1059 .0639 .1742  .031
Pb2   .2686 .0123 .3721  .031
Pb3       0  .562   .25  .031
Se1   .1626 1.508 .3293  .019
Se2   .0461  .003 .4147  .019
Cu1       0    .5    .5  .020
Cl1   .2971  .490  .456  .037
Cl2   .1203  .507  .534  .037
O1    .1810  .730  .270  .019
O2    .0641  .932  .309  .019
O3    .1886  .247  .285  .019
O4    .0067  .263  .382  .019
O5   -.0173  .807  .404  .019
O6    .1033  .430  .254  .019
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Sarrabusite
 
Gemmi M, Campostrini I, Demartin F, Gorelik T E, Gamaccioli C M
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=68&spage=15
Acta Crystallographica B68 (2012) 15-23
Structure of the new mineral sarrabusite, Pb5CuCl4(SeO3)4,
solved by manual electron-diffraction tomography
Note: Automated data
Locality: Baccu Locci mine, near Villaputzu, Sardinia, Italy
_database_code_amcsd 0018633
24.917 5.506 14.242 90 101.77 90 C2/c
atom      x     y     z  Uiso
Pb1   .1079 .0627 .1731 .0333
Pb2   .2680 .0103 .3680 .0333
Pb3       0 .5542   .25 .0333
Se1   .1649 .4985 .3261  .027
Se2   .0445 .0084 .4093  .027
Cu        0    .5    .5  .036
Cl1   .2931  .495 .4599  .035
Cl2   .1017  .499 .5323  .035
O1    .1859  .748 .2764  .026
O2    .0681  .888 .3061  .026
O3    .1944  .252 .2709  .026
O4    .0022  .253 .3816  .026
O5   -.0129  .788 .4094  .026
O6    .0995  .404 .2716  .026
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 2
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