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American Mineralogist Crystal Structure Database

1 matching records for this search.

Obradovicite-NaNa
  
Kampf A R, Mills S J, Rumsey M S, Dini M, Birch W D, Spratt J, Pluth J J, Steele I M,
Jenkins R A, Pinch W W
  
Mineralogical Magazine 76 (2012) 1175-1207
The heteropolymolybdate family: structural relations, nomenclature scheme and new species
Locality: Chuquicamata mine, Antofagasta, Chile
_database_code_amcsd 0019592
14.8866 11.0880 15.0560 90 90 90 Pnmb
atom       x      y      z occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Na1        0      0     .5 .76   .089   .123   .042   .103       0    .069       0
Mo1   .20915 .65997 .47922     .01298  .0129  .0129  .0131 -.00106 -.00069 -.00013
Mo2   .33768     .5 .32183     .01254  .0102  .0131  .0142       0  -.0002       0
Mo3   .38399     .5 .54912     .01694  .0122  .0226  .0160       0  -.0035       0
Fe1   .20109    .75    .25      .0148  .0162  .0123  .0160       0       0   .0018
Fe2        0     .5     .5      .0155  .0136  .0170  .0159       0   .0027       0
As    .09972     .5 .30715     .01216  .0114  .0120  .0130       0  -.0005       0
O1     .1907     .5  .3784      .0123   .010   .014   .013       0  -.0033       0
O2     .2451     .5  .5450      .0165   .012   .024   .014       0  -.0010       0
O3     .2978  .6247  .2571      .0179  .0189  .0152  .0195   .0023   .0003   .0031
O4     .3386  .3867  .4339      .0176  .0148  .0220  .0160   .0001  -.0004   .0017
O5     .1984  .7538  .3829      .0182  .0207  .0163  .0176   .0025   .0032   .0010
O6     .0941  .6284  .5072      .0188  .0158  .0193  .0214  -.0011   .0025   .0008
O7     .1049  .8763  .2560      .0217  .0203  .0194   .025   .0052   .0063   .0078
O8     .0056     .5  .3670      .0213   .014   .033   .017       0    .000       0
O9     .3895  .3782  .6178      .0336   .028   .041   .032  -.0065  -.0131    .014
O10    .4494     .5  .3002      .0253   .013   .040   .024       0    .002       0
O11    .2399  .7607  .5592      .0239   .026   .025  .0214  -.0025  -.0026  -.0060
O12       .5     .5     .5      .0272   .009   .045   .027       0   -.001       0
Wat1   .1616      0  .4423 .97   .107   .211   .032   .077       0   -.042       0
Wat2  -.0315  .1635  .3862       .097   .077   .103   .112   -.018    .047   -.054
Na2A    .272    .75    .75 .42   .158
Na2B    .178    .75    .75 .32    .18
Na3A   .1806      0  .6200 .52   .056
Na3B    .216      0  .6214 .12   .017
Wat3   .4297  .1856  .3869 .93   .121
Wat4A  .1634      0  .7925 .46   .054
Wat4B  .1582   .938  .7889 .28   .044
Wat5    .360      0   .479 .60    .19
Wat6    .528    .25    .25 .33    .13


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	Total number of retrieved datasets: 1

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