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Cobaltneustadtelite |
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Krause W, Bernhardt H J, McCammon C A, Effenberger H |
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American Mineralogist 87 (2002) 726-738 |
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Neustadtelite and cobaltneustadtelite, the Fe- and Co- analogues of medenbachite |
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_database_code_amcsd 0002816 |
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9.144 6.146 9.337 83.30 70.67 87.14 P-1 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Bi12 .09029 .31050 .60632 .0624 .0265 .0215 -.0173 -.0141 -.0004 |
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Bi1 .6241 .2935 .5993 .475 .0473 .0355 .0273 -.0148 -.0094 -.0034 |
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Ca1 .6241 .2935 .5993 .025 .0473 .0355 .0273 -.0148 -.0094 -.0034 |
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Bi2 .5601 .3258 .6115 .475 .0426 .0310 .0269 -.0091 -.0130 -.0014 |
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Ca2 .5601 .3258 .6115 .025 .0426 .0310 .0269 -.0091 -.0130 -.0014 |
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FeM1 0 0 0 .0102 .0177 .0159 .0003 -.0052 -.0031 |
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FeM2 0 .5 0 .63 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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CoM2 0 .5 0 .16 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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NiM2 0 .5 0 .19 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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ZnM2 0 .5 0 .02 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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As .1666 .2080 .2147 .0172 .0186 .0169 .0013 -.0080 -.0047 |
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O1 .0658 .4426 .1952 .009 .027 .015 .012 .001 -.001 |
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OH2 .1318 .2563 .8879 .004 .025 .019 .003 -.001 -.005 |
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O3 .0800 -.0081 .1801 .018 .018 .027 .001 -.012 .000 |
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O4 .3445 .2432 .0832 .019 .022 .021 .010 -.009 -.016 |
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OH5 .1296 .6231 .4666 .5 .006 .040 .027 -.008 -.009 .013 |
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O5 .1296 .6231 .4666 .5 .006 .040 .027 -.008 -.009 .013 |
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O6 .1824 .1427 .3897 .039 .050 .027 .018 -.028 -.006 |
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FeM1* .5 0 0 .0102 .0177 .0159 .0003 -.0052 -.0031 |
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FeM2* .5 .5 0 .63 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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CoM2* .5 .5 0 .16 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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NiM2* .5 .5 0 .19 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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ZnM2* .5 .5 0 .02 .0144 .0181 .0193 .0042 -.0071 -.0070 |
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As* .6666 .2080 .2147 .0172 .0186 .0169 .0013 -.0080 -.0047 |
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O1* .5658 .4426 .1952 .009 .027 .015 .012 .001 -.001 |
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OH2* .6318 .2563 .8879 .004 .025 .019 .003 -.001 -.005 |
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O3* .5800 -.0081 .1801 .018 .018 .027 .001 -.012 .000 |
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O4* .8445 .2432 .0832 .019 .022 .021 .010 -.009 -.016 |
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OH5* .6296 .6231 .4666 .5 .006 .040 .027 -.008 -.009 .013 |
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O5* .6296 .6231 .4666 .5 .006 .040 .027 -.008 -.009 .013 |
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O6* .6824 .1427 .3897 .039 .050 .027 .018 -.028 -.006 |
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