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Ferrinatrite |
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Scordari F |
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Mineralogical Magazine 41 (1977) 375-383 |
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The crystal structure of ferrinatrite, Na3(H2O)3[Fe(SO4)3] and its relationship |
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to Maus's salt, (H3O)2K2{K0.5(H2O)0.5}6[Fe3O(H2O)3(SO4)6](OH)2 |
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Locality: Sierra Gorda, Chile |
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15.566 15.566 8.69 90 90 120 P-3 |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Na1 .08331 .63668 .07025 2.35 .00251 .00405 .00852 .00193 -.00052 -.00088 |
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Na2 .10843 .41626 .29914 2.64 .00316 .00351 .00841 .00081 -.00007 .00048 |
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Na3 .21859 .25030 .40021 2.39 .00307 .00299 .00850 .00115 -.00035 -.00012 |
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Fe1 1/3 2/3 .18650 .69 .00108 .00108 .00193 .00054 0 0 |
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Fe2 1/3 2/3 .68720 .70 .00111 .00111 .00176 .00056 0 0 |
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Fe3 0 0 0 .80 .00128 .00128 .00212 .00064 0 0 |
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Fe4 0 0 .5 .82 .00133 .00133 .00224 .00066 0 0 |
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S1 .33668 .51279 .42828 .84 .00146 .00131 .00249 .00089 .00022 .00005 |
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S2 .18098 .50891 .94452 .82 .00112 .00109 .00254 .00048 .00004 .00015 |
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S3 .14288 .16484 .74514 .86 .00108 .00134 .00254 .00054 .00004 -.00005 |
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O1 .25324 .54408 .81398 1.16 .00184 .00142 .00345 .00056 .00079 .00043 |
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O2 .37326 .58452 .56028 .95 .00183 .00174 .00236 .00119 -.00041 -.00092 |
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O3 .28405 .54582 .31703 1.20 .00234 .00177 .00354 .00132 -.00091 -.00033 |
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O4 .21278 .59338 .0581 1.14 .00199 .00164 .00293 .00093 .00007 -.00065 |
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O5 .26396 .41471 .48140 1.22 .00263 .00145 .00690 .00066 .00085 .00101 |
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O6 .42205 .51639 .35092 1.51 .00196 .00262 .00529 .00156 .00051 -.00024 |
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O7 .51623 .60019 .88666 1.63 .00266 .00296 .00573 .00225 .00068 -.00019 |
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O8 .57233 .75526 .02299 1.60 .00240 .00193 .00381 .00026 -.00122 -.00026 |
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O9 .02687 .11661 .12848 1.16 .00139 .00177 .00355 .00067 .00046 -.00048 |
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O10 .05994 .12309 .62772 .99 .00124 .00155 .00342 .00063 -.00017 -.00028 |
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O11 .23447 .18034 .66936 1.50 .00167 .00272 .00474 .00116 .00050 .00011 |
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O12 .15180 .25578 .80549 1.85 .00260 .00194 .00740 .00104 -.00046 -.00164 |
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Wat1 .24914 .28210 .12922 2.16 .00286 .00211 .00763 .00075 -.00029 .00054 |
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Wat2 .64289 .59199 .19949 2.26 .00333 .00254 .00818 .00129 -.00061 -.00044 |
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Wat3 .39206 .31598 .42872 1.89 .00314 .00424 .00770 .00235 .00069 .00170 |
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