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Tokkoite |
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Rozhdestvenskaya I V, Nikishova L V, Lazebnik Yu D, Lazebnik K A |
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Zeitschrift fur Kristallographie 189 (1989) 195-204 |
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The crystal structure of tokkoite and its relation to the structure of tinaksite |
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Locality: Murun massif, southwestern Yakutia, Russia |
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Note: anisotropic temperature factors taken from ICSD |
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_database_code_amcsd 0010996 |
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10.438 12.511 7.112 89.92 99.75 92.89 P-1 |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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K1 .3189 .1155 .2080 .85 2.80 .004074 .003139 .027327 -.001091 .001319 -.000314 |
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K2 .4419 .3564 .7323 1.63 .003553 .003507 .005801 .000000 .000451 -.000285 |
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Ca1 .0244 -.1176 -.1151 .87 1.10 .002937 .002530 .004427 .000117 .000555 .000714 |
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Ti1 .0244 -.1176 -.1151 .13 1.10 .002937 .002530 .004427 .000117 .000555 .000714 |
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Ca2 .0077 -.1188 .3748 .85 .95 .003174 .001377 .004682 .000818 .001250 .000114 |
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Na2 .0077 -.1188 .3748 .15 .95 .003174 .001377 .004682 .000818 .001250 .000114 |
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Ca3 .1208 .5872 -.0920 .855 .76 .001705 .001505 .003664 -.000058 -.000208 -.000200 |
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Fe3 .1208 .5872 -.0920 .075 .76 .001705 .001505 .003664 -.000058 -.000208 -.000200 |
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Mn3 .1208 .5872 -.0920 .04 .76 .001705 .001505 .003664 -.000058 -.000208 -.000200 |
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Mg3 .1208 .5872 -.0920 .03 .76 .001705 .001505 .003664 -.000058 -.000208 -.000200 |
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Ca4 .1241 .5831 .4042 .855 .87 .002108 .000961 .004631 .000019 .000625 .000257 |
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Fe4 .1241 .5831 .4042 .075 .87 .002108 .000961 .004631 .000019 .000625 .000257 |
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Mn4 .1241 .5831 .4042 .04 .87 .002108 .000961 .004631 .000019 .000625 .000257 |
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Mg4 .1241 .5831 .4042 .03 .87 .002108 .000961 .004631 .000019 .000625 .000257 |
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Si1 .3196 .8096 .4191 .91 .001682 .001505 .004478 .000409 .000208 .000029 |
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Si2 .3241 -.1891 -.0104 .94 .002582 .001345 .005038 .000019 .001076 .000285 |
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Si3 .1355 .3134 -.1203 .82 .001090 .001617 .003613 -.000019 -.000208 .000086 |
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Si4 .1328 .3119 .4347 .73 .001563 .001329 .003460 -.000039 .000729 -.000200 |
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Si5 .3178 .4211 .2018 .74 .001421 .001281 .004631 .000409 .000937 -.000114 |
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Si6 .2842 -.0167 .6949 1.05 .003576 .001425 .005191 .000117 .001180 .000057 |
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Si7 .4010 .6484 .7248 .85 .001847 .001569 .001934 .000409 .000312 .000314 |
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O2 .2778 .3500 .0062 .92 .002534 .002034 .003308 .000156 -.000590 -.002341 |
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O3 .2727 .3460 .3716 .98 .002558 .001457 .005954 .000545 .000486 -.000542 |
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O4 .4753 .4274 .2467 .66 .002203 .001409 .006361 -.000779 .003125 -.000828 |
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O5 .0936 .1938 -.0674 1.56 .003766 .001810 .008397 .000487 -.000312 .001285 |
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O6 .1730 .7656 .3941 .68 .001729 .001361 .002697 -.000798 -.001042 .000086 |
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O7 .1311 -.0258 .6599 1.48 .001374 .002082 .009160 -.000545 -.001840 .002398 |
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O8 .3487 -.0724 -.1023 1.39 .003103 .001201 .006615 -.000857 -.000417 .001227 |
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O9 .3428 -.0743 .5220 1.00 .002582 .001041 .008142 -.000623 .002743 -.000371 |
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O10 .3811 .8234 .2204 1.14 .003245 .001713 .004885 .001130 .003055 .000228 |
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O11 .4186 .7263 .5426 1.07 .000853 .003043 .008142 .000545 .000486 .001028 |
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O12 .4205 .7277 .9129 1.45 .005613 .002546 .004783 .001655 .000521 .000228 |
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O13 .1714 .3058 .6690 1.40 .005969 .002114 .002544 .000662 .001076 -.000143 |
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O14 .1777 .7688 -.0626 1.33 .001208 .002146 .006310 .000876 -.000660 -.000742 |
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O15 .0830 .1948 .3646 1.52 .002487 .001826 .010229 -.000370 -.001562 -.000771 |
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O16 .0334 .4052 .8847 .60 .000545 .001249 .004275 .001130 .001146 .000771 |
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O17 .0315 .4036 .3786 .94 .003221 .001361 .006615 -.001266 .000486 -.000942 |
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O18 .2697 .5780 .6945 .81 .001445 .002178 .000916 .000312 .000312 -.001570 |
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O19 .2610 .5352 .1891 .99 .002605 .001377 .003053 .000078 .001007 -.000171 |
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Oh1 .3405 .1073 .7022 1.72 .005732 .001393 .015368 -.001402 .000243 .001285 |
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F20 .1001 .9810 .1504 .61 2.37 .004382 .004580 .013333 -.000136 .000278 .002112 |
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OH20 .1001 .9810 .1504 .39 2.37 .004382 .004580 .013333 -.000136 .000278 .002112 |
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H .403 .104 .73 3.40 |
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View JMOL 3-D Structure (permalink) |
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