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Tsepinite-K |
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Rosenberg K A, Rastsvetaeva R K, Pekov I V, Chukanov N V, Verin I A |
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Doklady Akademii Nauk SSSR 393 (2003) 784-787 |
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Crystal structure of Sr-rich tsepinite |
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_database_code_amcsd 0012497 |
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14.490 14.23 7.881 90 117.28 90 Cm |
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atom x y z occ Uiso |
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K .499 .191 -.006 .21 .033 |
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Na .452 .141 .825 .10 .014 |
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Ca .452 .141 .825 .10 .014 |
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Ti1 .0000 .2406 .5000 .7 .0249 |
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Nb1 .0000 .2406 .5000 .3 .0249 |
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Ti2 .2427 .2477 .4825 .7 .0296 |
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Nb2 .2427 .2477 .4825 .3 .0296 |
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Sr1 .0006 .0 .473 .20 .018 |
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Sr2 .246 .0 .486 .14 .027 |
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Sr3 .9206 .2401 -.004 .15 .038 |
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Si1 .1991 .1098 .7833 .010 |
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Si2 .7979 .1105 .1978 .025 |
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Si3 .3085 .1088 .2211 .019 |
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Si4 .6846 .1110 .7467 .014 |
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O1 .244 .1286 .008 .037 |
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O2 .761 .132 .981 .058 |
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O3 .2666 .1604 .700 .029 |
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O4 .7263 .1741 .273 .039 |
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O5 .0993 .2398 .389 .008 |
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O6 .904 .236 .593 .061 |
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O7 .198 0 .742 .087 |
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O8 .776 0 .219 .028 |
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O9 .4233 .158 .305 .051 |
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O10 .5832 .1756 .691 .028 |
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O11 .251 .132 .342 .052 |
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O12 .7499 .1463 .646 .030 |
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O13 .322 0 .250 .12 |
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O14 .6545 0 .728 .012 |
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O15 .0849 .1308 .661 .018 |
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O16 .9204 .148 .309 .066 |
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Ba1 .442 0 .696 .04 .075 |
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Wat1 .442 0 .696 .34 .075 |
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Ba2 .586 0 .268 .03 .055 |
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Wat2 .586 0 .268 .11 .055 |
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Ba3 .916 0 .666 .07 .049 |
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Wat3 .916 0 .666 .31 .049 |
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Wat4 .112 0 .311 .38 .059 |
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Wat5 .546 .090 .149 .36 .044 |
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Wat6 .001 .162 .012 .40 .061 |
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Wat7 .480 .155 .973 .20 .040 |
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Wat8 .475 .041 .778 .11 .048 |
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Wat9 .979 .089 .86 .22 .031 |
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Wat10 .588 .265 .990 .15 .025 |
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