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American Mineralogist Crystal Structure Database

1 matching records for this search.

Sidpietersite
Download hom/sidpietersite.pdf 
Cooper M A, Hawthorne F C
Download cm/vol37/CM37_1275.pdf 
The Canadian Mineralogist 37 (1999) 1275-1282
The structure topology of sidpietersite, Pb4(SO3S)O2(OH)2,
a novel thiosulfate structure
_database_code_amcsd 0005630
7.455 6.496 11.207 114.33 89.65 88.69 P-1
atom     x      y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1  .1221  .7483 .0063 .0191  .0159  .0152  .0255  .0007 -.0002  .0079
Pb2  .6198  .5932 .3116 .0235  .0168  .0311  .0219  .0003  .0022  .0104
Pb3  .1030  .6262 .3048 .0233  .0180  .0309  .0200 -.0030 -.0011  .0094
Pb4  .6275  .7487 .0275 .0182  .0146  .0155  .0239 -.0003  .0016  .0077
S1   .3704  .1253 .3160 .0193  .0236  .0135  .0181 -.0019 -.0026  .0038
S2   .1509  .2040 .4275 .0350  .0289  .0422  .0314  .0033  .0056  .0130
O1    .530   .185  .390 .0469  .0262  .0580  .0607  .0013  .0142  .0292
O2    .352   .246  .229 .0400  .0542  .0259  .0438 -.0079  .0055  .0180
O3    .372  -.127  .231 .0285  .0376  .0103  .0227 -.0069 -.0079 -.0085
O4    .128   .475  .085 .0191  .0245  .0223  .0057  .0086  .0052  .0015
O5    .615   .450  .084 .0238  .0250  .0130  .0326  .0074  .0031  .0088
OH1   .874   .357  .245 .0228  .0198  .0397  .0132  .0021  .0041  .0154
OH2   .841   .796  .256 .0251  .0340  .0339  .0108 -.0095 -.0104  .0122


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