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Na9[P2W15Nb3O62].2C2H3N.23H2O |
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Finke R G, Lyon D K, Nomiya K, Weakley T J R |
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Acta Crystallographica C46 (1990) 1592-1596 |
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Structure of nonasodium alpha-triniobatopentadecawolframatodiphosphate- |
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acetonitrile-water(1/2/23), Na9[P2W15Nb3O62].2CH3CN.23H2O |
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_database_code_amcsd 0010175 |
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13.341 15.890 21.395 87.85 77.18 71.87 P-1 |
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atom x y z occ Biso |
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W1 .63511 .60820 .17508 .72 1.45 |
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Nb1 .63511 .60820 .17508 .28 1.45 |
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W2 .59018 .60882 .33811 .72 1.56 |
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Nb2 .59018 .60882 .33811 .28 1.56 |
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W3 .84685 .54932 .24896 .72 1.61 |
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Nb3 .84685 .54932 .24896 .28 1.61 |
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W4 .47121 .45779 .17925 1.16 |
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W5 .42456 .46031 .33962 1.22 |
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W6 .65101 .39637 .42044 1.25 |
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W7 .90477 .33643 .33172 1.25 |
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W8 .95574 .33607 .15602 1.24 |
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W9 .74901 .39407 .08262 1.17 |
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W10 .47415 .22095 .17605 1.20 |
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W11 .42854 .22174 .33648 1.23 |
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W12 .65517 .15927 .41608 1.24 |
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W13 .90925 .09897 .32718 1.22 |
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W14 .95938 .09850 .15288 1.24 |
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W15 .74951 .15686 .08035 1.13 |
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Nb1 .64115 -.01548 .16825 .72 1.4 |
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W1 .64115 -.01548 .16825 .28 1.4 |
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Nb2 .59840 -.01493 .33047 .72 1.4 |
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W2 .59840 -.01493 .33047 .28 1.4 |
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Nb3 .85479 -.07505 .24081 .72 1.4 |
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W3 .85479 -.07505 .24081 .28 1.4 |
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P1 .6934 .4081 .2517 1.2 |
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P2 .6971 .1500 .2479 1.0 |
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Na1 .7002 .7780 .0547 2.5 |
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Na2 .2954 -.1522 .2359 4.5 |
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Na3 .2570 -.0715 .0927 3.5 |
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Na4 .0047 .3296 -.0226 4.0 |
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Na5 .0182 .6891 .1677 4.8 |
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Na6 .5840 .7985 .4548 4.6 |
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Na7 .6393 .1435 .6078 8.8 |
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O1 .6024 .6946 .1264 1.9 |
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O2 .5274 .6995 .3898 1.4 |
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O3 .9449 .5989 .2475 2.4 |
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O4 .3819 .4997 .1308 1.5 |
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O5 .3045 .5078 .3916 2.6 |
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O6 .6032 .4173 .5034 1.8 |
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O7 .0221 .3238 .3550 1.3 |
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O8 .0921 .3185 .1237 2.3 |
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O9 .7520 .4177 .0029 1.7 |
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O10 .3807 .2371 .1274 1.6 |
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O11 .3091 .2346 .3904 2.0 |
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O12 .6093 .1499 .4955 1.7 |
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O13 .0261 .0563 .3517 2.0 |
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O14 .0917 .0536 .1188 1.9 |
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O15 .7565 .1435 -.0022 1.6 |
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O16 .6086 -.0801 .1141 2.6 |
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O17 .5347 -.0777 .3851 2.9 |
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O18 .9609 -.1745 .2351 2.8 |
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O19 .6902 .5062 .2518 .6 |
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O20 .5778 .4072 .2535 1.7 |
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O21 .7697 .3644 .1892 .6 |
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O22 .7355 .3599 .3097 .9 |
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O23 .6976 .0520 .2478 1.3 |
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O24 .5785 .2067 .2543 .8 |
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O25 .7712 .1618 .1864 1.1 |
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O26 .7373 .1635 .3059 .9 |
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O27 .7693 .6144 .1875 2.1 |
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O28 .7370 .6153 .3176 1.5 |
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O29 .5672 .6663 .2593 1.4 |
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O30 .5668 -.0475 .2509 2.8 |
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O31 .7471 -.0946 .3105 1.7 |
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O32 .7823 -.0907 .1743 1.9 |
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O33 .5179 .5612 .1829 1.9 |
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O34 .4767 .5597 .3332 1.2 |
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O35 .6392 .5127 .3921 2.1 |
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O36 .8813 .4582 .3086 1.6 |
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O37 .9124 .4617 .1835 1.7 |
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O38 .7214 .5156 .1139 2.3 |
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O39 .5238 .0989 .1775 1.7 |
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O40 .4823 .1003 .3299 1.3 |
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O41 .6438 .0549 .3889 1.8 |
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O42 .8870 -.0048 .3030 1.0 |
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O43 .9229 -.0041 .1792 .6 |
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O44 .7193 .0548 .1072 1.0 |
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O45 .3762 .4956 .2610 2.2 |
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O46 .5202 .4117 .3948 1.1 |
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O47 .9559 .3062 .2425 1.3 |
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O48 .7989 .3758 .4110 1.0 |
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O49 .8952 .3723 .0820 1.0 |
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O50 .6025 .4095 .1163 1.2 |
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O51 .3789 .2282 .2593 .9 |
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O52 .5266 .2148 .3903 1.1 |
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O53 .8042 .1135 .4078 2.3 |
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O54 .9623 .1181 .2391 1.3 |
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O55 .8963 .1079 .0780 1.0 |
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O56 .6042 .2145 .1147 1.6 |
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O57 .4533 .3450 .1890 1.4 |
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O58 .4153 .3462 .3298 1.5 |
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O59 .6767 .2727 .4190 1.6 |
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O60 .8974 .2196 .3428 1.2 |
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O61 .9559 .2187 .1409 1.7 |
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O62 .7721 .2704 .0765 1.8 |
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O63 .8453 .7405 .1229 3.3 |
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O64 .9170 .2575 -.0683 4.4 |
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O65 .8101 .6238 .0186 4.7 |
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O66 .8471 .8114 -.0121 4.2 |
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O67 .4427 -.1590 .2815 3.0 |
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O68 .1717 -.1511 .1721 4.3 |
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O69 .5824 .8504 -.0122 3.9 |
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O70 .7581 .7549 .3828 4.4 |
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O71 .3635 -.0137 .0128 4.4 |
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O72 .6251 .6575 .5044 6 |
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O73 .3134 -.3022 .2665 4.6 |
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O74 .4160 -.1453 .1286 5.4 |
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O75 .6166 .9198 .5086 7 |
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O76 .1835 .6349 .1984 9 |
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O77 .7193 .2723 .5949 6 |
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O78 .9656 .4427 -.0942 5 |
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O79 .1688 -.1184 .3299 10 |
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O80 .2874 .0149 .3906 15 |
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O81 .9524 .9080 .0420 3 |
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O82 .2253 .4289 .0973 4 |
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O83 .8422 .9146 .4415 2 |
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N1 .2670 .0018 .2085 10 |
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N2 .6645 .2937 -.0916 9 |
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C1 .2433 .0703 .2265 10 |
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C2 .1792 .1819 .2256 12 |
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C3 .5868 .3289 -.0555 6 |
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C4 .4955 .3750 -.0140 8 |
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