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American Mineralogist Crystal Structure Database

1 matching records for this search.

Elyite
Download hom/elyite.pdf
Kolitsch U, Giester G
Download am/vol85/AM85_1816.pdf
American Mineralogist 85 (2000) 1816-1821
Elyite, Pb4Cu(SO4)O2(OH)4.H2O: Crystal structure and new data
_database_code_amcsd 0002598
14.233 11.532 14.611 90 100.45 90 P2_1/c
atom        x       y        z Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3)  U(2,3)
Pb1    .76199  .24357  .167887      .02173 .01424 .01158 -.00057 .00177  .00083
Pb2   .886214 -.02750   .07928      .01177 .01353 .02118  .00018 .00491 -.00124
Pb3   .882928  .01208   .54651      .01092 .01528 .02152 -.00171 .00120  .00059
Pb4    .73814 -.24952  .405103      .01619 .01425 .01306  .00095 .00477  .00180
Pb5    .75268  .23200 -.075258      .01742 .01608 .01398  .00005 .00553 -.00243
Pb6    .74581 -.23237  .652309      .01706 .01538 .01310  .00016 .00146 -.00274
Pb7   .627551  .00700   .49958      .01130 .01344 .01977  .00175 .00427 -.00042
Pb8   .629953 -.00198   .03815      .01138 .01334 .01997 -.00096 .00170 -.00056
Cu1    .75912  .00198   .29219       .0191  .0145  .0146   .0000  .0040  -.0015
Cu2    .49357 -.24673   .47751       .0113  .0124  .0140  -.0024  .0029  -.0004
S1     .59143 -.00318  -.23283       .0196  .0198  .0121   .0032  .0025  -.0025
S2     .01662  .22104   .08822       .0128  .0189  .0202  -.0003  .0027   .0007
O1      .5301   .0978   -.2246        .027   .030   .020    .013  -.002   -.005
O2      .6535   .0213   -.3017        .027   .034   .023   -.005   .012   -.002
O3      .5304  -.1047   -.2629        .028   .029   .031   -.009   .010   -.006
O4      .6539  -.0264   -.1421        .032   .031   .017    .015  -.009   -.005
O5      .0696   .3283    .0835        .027   .020   .076   -.007  -.001    .005
O6      .0842   .1247    .1069        .023   .022   .042    .006  -.001    .010
O7      .9610   .2271    .1629        .025   .093   .022    .009   .008   -.008
O8      .9519   .2019   -.0006        .017   .035   .023    .000   .002    .004
O9      .7601   .3546    .0454        .016   .011   .013  -.0012   .001  -.0005
O10     .7642   .0999    .0629        .012   .011   .018   .0022   .001  -.0009
O11     .7547  -.1465    .0347        .016   .012   .013  -.0015   .004  -.0018
O12     .7562  -.1038    .5176        .010   .011   .018  -.0015   .000   -.003
O(H1)   .6679  -.0752    .1993        .023   .021   .015   -.003   .004   -.004
O(H2)   .6662   .0746    .3539        .017   .019   .019   -.002   .004   -.002
O(H3)   .8523   .0751    .3882        .017   .018   .020   -.003   .005   -.002
O(H4)   .8569  -.0609    .2282        .025   .033   .019    .010   .003    .001
O(H5)   .5766  -.1780    .4030        .014   .022   .011   -.005   .002   -.002
O(H6)   .4056  -.3004    .5536        .014   .024   .016   -.003   .004    .002
O(H7)   .5880  -.2011    .5833        .014   .027   .017    .002   .005   -.002
O(H8)   .4041  -.3094    .3733        .016   .025   .015   -.006   .005   -.005
O(W1)   .0390   .2145    .3520        .034   .057   .031    .012   .013    .005
O(W2)   .8493   .4822    .2362        .040   .039   .044   -.008   .007   -.018
H1       .638   -.090     .233  .06
H2       .634    .114     .328  .04
H3       .898    .078     .363  .05
H4       .912   -.073     .271  .05
H5       .565   -.177     .352  .07
H6       .441   -.303     .596  .06
H7       .547   -.184     .614  .04
H8       .440   -.308     .336  .06
H9       .995    .224     .376  .05
H10      .889    .522     .283  .06
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Total number of retrieved datasets: 1
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