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Sr2Fe2F10*(H2O) |
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Le Meins J, Hemon-Ribaud A, Courbion G |
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Acta Crystallographica C53 (1997) 1165-1166 |
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Sr2Fe2F10*(H2O), the first hydrated strontium iron(III) fluoride |
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_cod_database_code 1000441 |
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_database_code_amcsd 0010312 |
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7.848 19.86699 10.773 90 90 90 Cmca |
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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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Sr1 .25 .28088 .25 .0069 .0114 .0109 0 -.0007 0 |
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Sr2 0 .11917 .45274 .0068 .0083 .0093 0 0 -.0006 |
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Fe1 .25 .46627 .25 .0080 .0066 .0097 0 -.0013 0 |
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Fe2 0 .18264 .06392 .0073 .0079 .0082 0 0 .0002 |
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F1 .1994 .39572 .1356 .0144 .0124 .0141 .0008 -.002 -.0025 |
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F2 .2403 .18836 .0780 .0077 .0145 .0211 .0013 .0001 -.0032 |
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F3 .2919 .03352 .1268 .0137 .0166 .0265 -.0024 -.0006 .0107 |
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F4 0 .3010 .3880 .014 .016 .010 0 0 -.0024 |
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F5 0 .1800 .2468 .018 .020 .0107 0 0 .002 |
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F6 0 .4704 .2890 .0094 .017 .020 0 0 -.001 |
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F7 0 .28067 .1019 .0074 .0088 .015 0 0 -.0009 |
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O1 0 .0841 .0472 .014 .0054 .023 0 0 .003 |
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H1 .098 .0527 .083 |
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F2 Fe O4 P Sr |
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Le Meins J, Hemon-Ribaud A, Laligant Y, Courbion G |
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European Journal of Solid State and Inorganic Chemistry 34 (1997) 391-404 |
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A new fluorophosphate with a laueite-type structural unit: synthesis, |
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TEM study and crystal structure of Sr Fe P O4 F2 |
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_cod_database_code 1000430 |
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_database_code_amcsd 0012609 |
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5.207 12.216 7.037 90 103.00 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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Sr1 .4595 .2040 .3105 .018 .010 .011 -.004 -.002 .002 |
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Fe1 0 0 .5 .010 .007 .005 .000 .001 -.001 |
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Fe2 0 0 0 .009 .006 .006 .000 .001 .000 |
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P1 .4350 .1155 .8051 .008 .007 .006 .000 .002 .000 |
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O1 .4262 .2204 .6898 .018 .009 .012 .001 .005 .006 |
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O2 .3560 .0157 .6701 .011 .010 .010 -.001 .001 -.004 |
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O3 .2370 .1224 -.0575 .010 .008 .009 -.001 .004 -.001 |
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O4 .2886 .8987 .0633 .008 .011 .013 .001 -.002 -.003 |
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F1 .3840 .3549 .0517 .015 .008 .011 -.001 .001 .001 |
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F2 .1082 .0586 .2710 .014 .012 .006 -.004 .002 .000 |
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Sr2Ga(HPO4)(PO4)F2 |
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Le Meins J, Hemon-Ribaud A, Courbion G |
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European Journal of Solid State and Inorganic Chemistry 35 (1998) 117-132 |
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Synthesis and crystal structure of two fluorophosphated compounds with |
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different infinite sheets: Sr2Ga(HPO4)(PO4)F2 and Sr2Fe2(HPO4)(PO4)2F2 |
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_cod_database_code 1000486 |
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_database_code_amcsd 0012619 |
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8.257 7.205 13.596 90 108.02 90 P2_1/n |
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atom x y z |
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Sr1 .2025 .1710 .0773 |
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Sr2 .2197 .1687 .5514 |
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Ga1 .0205 .0054 .2908 |
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P1 .4071 .1988 .3695 |
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P2 .3557 .1150 .8463 |
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O1 .2595 .0605 .3591 |
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O2 .3993 .3399 .4526 |
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O3 -.0031 .5102 .3208 |
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O4 .3128 .0306 -.0638 |
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O5 .3826 .2973 .2650 |
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O6 .2045 .1160 .7460 |
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O7 -.0773 .5970 .0950 |
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O8 -.0580 .1950 .3715 |
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F1 .4426 .3714 .0787 |
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F2 -.0099 .1653 .1785 |
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Sr2Fe2(HPO4)(PO4)2F2 |
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Le Meins J, Hemon-Ribaud A, Courbion G |
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European Journal of Solid State and Inorganic Chemistry 35 (1998) 117-132 |
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Synthesis and crystal structure of two fluorophosphated compounds with |
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different infinite sheets: Sr2Ga(HPO4)(PO4)F2 and Sr2Fe2(HPO4)(PO4)2F2 |
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_cod_database_code 1000487 |
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_database_code_amcsd 0012620 |
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8.072 8.794 8.885 102.46 115.95 89.95 P-1 |
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atom x y z |
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Sr1 .3948 .6961 .5817 |
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Sr2 .1956 .1965 .5761 |
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Fe1 .6741 .4278 .8373 |
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Fe2 .8317 .0768 .1618 |
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P1 .0021 .4344 .2389 |
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P2 .2319 -.0580 .2438 |
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P3 .5503 .7453 .0012 |
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O1 -.0669 .5398 .3619 |
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O2 .2996 .7865 .2816 |
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O3 .0549 -.0322 .2644 |
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O4 .3871 .0705 .3946 |
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O5 .6316 .6491 .8891 |
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O6 .3723 .7931 .8696 |
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O7 .0136 .2709 .2753 |
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O8 .5205 .6528 .1165 |
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O9 .2110 -.0366 .0724 |
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O10 .6857 .8862 .1325 |
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O11 .1974 .5055 .2902 |
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O12 .8730 .4307 .0537 |
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F1 .8466 .1120 .4116 |
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F2 .4423 .4103 .5982 |
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NaCaAlF6 |
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Le Bail A, Hemon-Ribaud A, Courbion G |
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European Journal of Solid State and Inorganic Chemistry 35 (1998) 265-272 |
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Structure of alpha-(NaCaAlF6) determined ab initio from |
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conventional powder diffraction data |
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_cod_database_code 1000149 |
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_database_code_amcsd 0012622 |
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8.7423 5.1927 20.35139 90 91.499 90 P2_1/c |
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atom x y z |
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Na1 .9768 .2543 .1781 |
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Na2 .9681 .2734 .4413 |
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Ca1 .6403 .2375 .3108 |
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Ca2 .6357 .3219 .5623 |
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Al1 .2588 .2561 .3189 |
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Al2 .2528 .1903 .5688 |
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F1 .6290 .6261 .4777 |
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F2 .5863 .6137 .6397 |
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F3 .7338 .0827 .4824 |
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F4 .3809 .1003 .2626 |
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F5 .1625 -.0247 .6328 |
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F6 .1643 .4377 .3814 |
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F7 .2357 .4669 .6229 |
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F8 .5786 .5944 .8821 |
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F9 .9132 .6404 .2260 |
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F10 .7403 .0217 .2307 |
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F11 .7551 .0334 .6259 |
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F12 .0748 .2790 .5398 |
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Sr2Fe2(HPO4)(PO4)2F2 |
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Le Meins J, Hemon-Ribaud A, Courbion G |
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European Journal of Solid State and Inorganic Chemistry 45 (1998) 117-132 |
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Synthesis and crystal structure of two fluorophosphated compounds with |
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different infinite sheets: Sr2Ga(HPO4)(PO4)F2 and Sr2Fe2(HPO4)(PO4)2F2 |
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_cod_database_code 1000487 |
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_database_code_amcsd 0012630 |
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8.072 8.794 8.885 102.46 115.95 89.95 P-1 |
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atom x y z |
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Sr1 .3948 .6961 .5817 |
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Sr2 .1956 .1965 .5761 |
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Fe1 .6741 .4278 .8373 |
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Fe2 .8317 .0768 .1618 |
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P1 .0021 .4344 .2389 |
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P2 .2319 -.0580 .2438 |
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P3 .5503 .7453 .0012 |
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O1 -.0669 .5398 .3619 |
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O2 .2996 .7865 .2816 |
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O3 .0549 -.0322 .2644 |
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O4 .3871 .0705 .3946 |
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O5 .6316 .6491 .8891 |
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O6 .3723 .7931 .8696 |
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O7 .0136 .2709 .2753 |
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O8 .5205 .6528 .1165 |
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O9 .2110 -.0366 .0724 |
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O10 .6857 .8862 .1325 |
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O11 .1974 .5055 .2902 |
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O12 .8730 .4307 .0537 |
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F1 .8466 .1120 .4116 |
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F2 .4423 .4103 .5982 |
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Al6 F34 Na2 Sr7 |
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Hemon-Ribaud A, Crosnier-Lopez M, Fourquet J, Courbion G |
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Journal of Fluorine Chemistry 68 (1994) 155-163 |
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On new fluorides with the jarlite-type structure: crystal structures of |
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Na2 Sr7 Al6 F34, Na2 Sr6 Zn Fe6 F34 and Ba7 Ga6 (F, OH)32 . 2H2O |
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_cod_database_code 1000398 |
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_database_code_amcsd 0013024 |
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16.07199 10.822 7.258 90 101.23 90 C2/m |
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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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Sr1 0 0 0 .0062 .0105 .0122 0 .0007 0 |
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Sr2 .26095 0 .12281 .0097 .0097 .0128 0 .0027 0 |
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Sr3 .14543 .30113 .30265 .0077 .0116 .0090 .0016 .0012 -.0003 |
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Al1 .16876 0 .5441 .0082 .0065 .0060 0 .0018 0 |
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Al2 .11009 .2428 .7991 .0067 .0074 .0061 .0004 .0020 .0001 |
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Na1 0 .5 .5 .0078 .0104 .0088 0 .0033 0 |
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Na2 0 .5 0 .0133 .0260 .0119 0 -.0017 0 |
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F1 .3836 .1306 .0354 .149 .0102 .0110 -.0001 .0035 -.0025 |
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F2 .4052 .1487 .3899 .0217 .0223 .0128 .0079 .0071 .0082 |
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F3 .2783 .2409 .1883 .0083 .0154 .0132 -.0008 .0035 -.0001 |
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F4 .1305 .1323 .9943 .0109 .0117 .0152 .0000 .0023 .0057 |
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F5 .2312 .1165 .4570 .0143 .0161 .0174 -.0055 .0016 .0061 |
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F6 .0002 .2210 .7955 .0077 .0210 .0171 .0013 .0026 -.0008 |
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F7 .1066 .1171 .6292 .0124 .0203 .0251 .0047 -.0011 -.0146 |
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F8 .2462 0 .7622 .0101 .0168 .0101 0 -.0011 0 |
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F9 .1020 0 .3167 .0189 .0262 .0087 0 -.0020 0 |
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F10 .4235 0 .7188 .0129 .0103 .0104 0 .0023 0 |
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F32 Fe7 Na7 Sr2 |
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Hemon-Ribaud A, Greneche J, Courbion G |
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Journal of Solid State Chemistry 112 (1994) 82-91 |
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Synthesis, crystal structure, and magnetic study of Na7Sr2Fe7F32 |
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_cod_database_code 1000360 |
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_database_code_amcsd 0013822 |
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10.372 10.805 44.98 90 90 90 *Fddd |
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.125 .125 .125 |
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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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Sr1 .125 .125 .25704 .0127 .0203 .0145 .0041 0 0 |
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Fe1 .125 .125 .625 .0131 .0057 .0062 0 0 0 |
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Fe2 .5 .5 .5 .0067 .0073 .0105 -.0001 .0006 .0001 |
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Fe3 .1110 .3615 .18213 .0137 .0066 .0080 .0019 -.0003 .0003 |
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Na1 .125 .125 .125 .0383 .0051 .0100 0 0 0 |
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Na2 .125 .125 .3793 .0379 .0598 .0175 .0238 0 0 |
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Na3 .1226 .3770 .3162 .0468 .0229 .0361 .0080 .0084 -.0026 |
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F1 .0024 .2780 .1547 .0295 .0257 .0215 .0016 -.0112 -.0086 |
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F2 .0680 .0040 .0378 .0216 .0173 .0206 .0041 -.0012 .0093 |
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F3 .1133 .3910 .2612 .0166 .0226 .0200 -.0110 .0026 .0021 |
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F4 .0195 .0370 .3012 .0162 .0153 .030 .0075 .0005 -.0030 |
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F5 .0119 .4478 .0416 .0148 .0202 .0139 .0033 .0011 .0051 |
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F6 .0008 .0247 .8351 .0209 .0245 .0209 .0063 -.0085 .0014 |
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F7 .1072 .4968 .0958 .1704 .0234 .0208 -.0010 .0027 -.0163 |
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F8 .125 .125 .5081 .0281 .0328 .0247 -.0216 0 0 |
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F9 .4478 .125 .125 .0141 .0659 .1889 0 0 -.0003 |
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