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Kanonerovite |
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Lightfoot P, Cheetham A K |
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Acta Crystallographica C43 (1987) 4-7 |
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Structure of manganese(II) trisodium tripolyphosphate dodecahydrate |
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Locaality: synthetic |
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_database_code_amcsd 0020872 |
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14.763 9.325 15.140 90 89.87 90 P2_1/n |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Mn1 .25136 .04405 .81774 .0173 .0116 .0170 -.0007 .0009 .0000 |
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P1 .39221 .2766 .91092 .0155 .0123 .0191 .0006 -.0003 -.0017 |
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P2 .09508 .2697 .90466 .0148 .0135 .0175 .0004 .0007 .0010 |
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P3 .24157 .1550 .01758 .0158 .0157 .0152 -.0006 .0003 .0002 |
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Na1 -.1438 .4642 .7092 .030 .025 .031 -.004 -.0006 -.001 |
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Na2 .1134 .1944 .1999 .029 .049 .043 -.017 .004 .002 |
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Na3 -.7534 .2642 .5628 .028 .021 .034 -.006 .0001 .0014 |
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O1 .3578 .1968 .8300 .020 .018 .021 .000 .001 -.002 |
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O2 .2509 .0220 .9632 .028 .014 .018 -.001 .001 .000 |
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O3 .1429 -.3666 .0165 .027 .029 .033 -.008 .006 -.002 |
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O4 .0953 .4308 .8962 .027 .012 .029 .001 .001 .002 |
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O5 .1477 .3635 .6787 .022 .019 .025 .004 .001 -.002 |
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O6 .4023 .4355 .8938 .025 .012 .030 .002 .000 -.001 |
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O7 -.0130 .6050 .7854 .033 .032 .038 .001 -.003 .003 |
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O8 .2491 .5497 .8262 .021 .021 .021 .004 .001 .002 |
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O9 .0059 .0829 .1048 .036 .025 .032 -.003 .009 -.005 |
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O10 .1456 .1970 .8300 .027 .018 .019 .001 .001 .006 |
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O11 .6291 .3501 .9839 .025 .031 .033 -.010 .001 -.003 |
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O12 -.1566 .1394 .1790 .019 .021 .024 -.004 -.001 -.004 |
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O13 .4739 .2056 .9503 .026 .021 .039 .002 -.009 .001 |
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O14 .3126 .2710 .9847 .035 .028 .031 -.011 .015 -.016 |
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O15 .2457 .1457 .1148 .022 .033 .018 .000 .000 .007 |
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O16 .0021 .2072 .9219 .018 .020 .032 -.004 .003 -.002 |
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O17 .1492 .2335 .9960 .027 .029 .019 -.002 -.002 .012 |
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O18 -.0182 .4371 .6092 .033 .029 .028 -.003 .001 -.007 |
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O19 .0681 .0143 .3109 .031 .040 .049 -.012 .003 .001 |
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O20 .2235 -.5287 .1571 .068 .040 .035 -.004 .002 .018 |
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O21 .1962 .2955 .3235 .032 .032 .037 .006 .000 -.001 |
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O22 .1194 -.2350 .2216 .035 .030 .032 -.004 -.006 .005 |
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H1 .020 .538 .821 |
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H2 .262 .296 .324 |
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H3 .083 -.213 .173 |
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H4 .576 .296 .967 |
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H5 -.102 .132 .148 |
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H6 .176 .227 .367 |
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H7 .194 -.487 .108 |
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H8 .118 -.435 -.024 |
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H9 .133 .320 .732 |
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H10 .608 .423 .020 |
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H11 .103 -.170 .265 |
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H12 .407 .179 .461 |
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H13 .855 .185 .232 |
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H14 .296 .497 .852 |
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H15 .093 .392 .653 |
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H16 .194 .515 .848 |
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H17 .004 .007 .325 |
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H18 .010 .114 .045 |
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H19 .781 .08 .637 |
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H20 .022 .620 .733 |
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H21 .977 .014 .892 |
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H22 -.026 .383 .558 |
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H23 -.006 .532 .591 |
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H24 .095 .032 .367 |
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