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Kazakovite |
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Voronkov A A, Pudovkina Z V, Blinov V A, Ilyukhin V V, Pyatenko Y A |
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Doklady Akademii Nauk SSSR 245 (1979) 106-109 |
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Crystal structure of kazakovite Na6Mn{Ti[Si6O18]} |
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_database_code_amcsd 0012462 |
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7.310 7.310 7.310 88.11 88.11 88.11 R-3m |
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atom x y z occ Biso |
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Na1 0 0 .5 1.59 |
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Na2 .5 .5 0 2.08 |
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Mn .2438 .2438 .2438 .5 1.60 |
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Ti 0 0 0 .22 |
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Si .2791 .2791 .7348 .78 |
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O1 .2133 .2133 .5472 1.98 |
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O2 .1843 .1843 .9149 1.46 |
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O3 .2416 .7584 .5 1.83 |
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Zirsinalite |
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Pudovkina Z V, Chernitsova N M, Voronkov A A, Pyatenko Yu A |
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Doklady Akademii Nauk SSSR 250 (1980) 865-867 |
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Crystal structure of zirsinalite Na6Ca{Zr(Si6O18)} |
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Locality: Koashva Mountain, Khibiny Massif, Kola Peninsula, Russia |
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_database_code_amcsd 0012464 |
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10.593 10.593 10.593 58.13 58.13 58.13 R-3c |
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atom x y z occ Biso |
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Na1 .5 0 0 1.22 |
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Na2 .743 .757 .25 1.15 |
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Ca .3767 .3767 .3767 .5 1.16 |
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Zr 0 0 0 .93 |
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Si .1307 .1346 .5853 .93 |
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O1 .255 .296 .938 1.31 |
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O2 .950 .234 .968 1.33 |
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O3 .013 .487 .25 3.31 |
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O4 .518 .982 .25 1.24 |
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Imandrite |
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Chernitsova N M, Pudovkina Z V, Voronkov A A, Ilyukhin V V, Pyatenko Y A |
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Doklady Akademii Nauk SSSR 252 (1980) 618-621 |
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Imandrite Na12Ca3Fe2[Si6O18]2 - a representative of |
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a new branch in the lovozerite structural family |
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_database_code_amcsd 0012468 |
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10.331 10.546 7.426 90 90 90 Pmnn |
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atom x y z occ Biso |
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Na1 0 0 .5 .19 |
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Na2 .2407 .2334 .0207 1.61 |
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Na3 .5 0 0 3.97 |
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Ca .5 .2549 .7563 .75 .96 |
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Fe 0 0 0 .99 |
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Si1 .2723 .9920 .7152 .69 |
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Si2 .5 .2184 .2564 .77 |
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O1 0 .199 .935 2.04 |
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O2 .128 .376 .755 2.38 |
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O3 .5 .290 .073 1.50 |
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O4 .364 .444 .697 1.68 |
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O5 .329 .121 .787 1.94 |
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O6 .240 0 .5 2.89 |
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Catapleiite |
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Ilyushin G D, Voronkov A A, Ilyukhin V V, Nevskii N N, Belov N V |
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Doklady Akademii Nauk SSSR 260 (1981) 623-627 |
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Crystal structure of natural monoclinic catapleiite, Na2ZrSi3O9*2H2O |
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_database_code_amcsd 0012471 |
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23.917 20.148 7.432 90 90 147.46 B2/b |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Na1 0 0 .5 .6667 .043819 .026807 .030703 .029042 -.001815 -.000371 |
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Na2 .25 0 .25 .6667 .066577 .046442 .053624 .043788 -.004157 .006252 |
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Na3 .25 0 .75 .6667 .010880 .005263 .023545 .006437 .002989 -.003729 |
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Na4 0 .25 .5059 .6667 .032274 .039731 .019321 .034390 .000000 .000000 |
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Na5 .2531 .2550 .7568 .6667 .026275 .030369 .028683 .026057 .004562 .010089 |
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Zr1 0 0 0 .013546 .011689 .012244 .011243 .000282 -.000093 |
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Zr2 0 .25 .0074 .012794 .010974 .011236 .010471 .000000 .000000 |
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Si1 .0976 .2221 .2996 .006324 .005217 .004486 .005144 -.001313 -.001331 |
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Si2 .0995 .2252 .7077 .007604 .006589 .003337 .006294 .001722 .001290 |
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Si3 .1972 .5723 .9985 .004183 .003723 .006391 .003268 .000081 .000181 |
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O1 .3661 .9233 .4912 .022414 .029674 .026378 .024586 -.002138 -.002760 |
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O2 .3666 .0586 .5100 .019021 .008094 .030548 .010321 -.000672 -.000928 |
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O3 .0493 .1747 .5045 .009163 .014371 .006936 .008104 .000732 .000456 |
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O4 .0711 .1285 .8027 .024338 .017391 .025717 .018152 .005997 .010263 |
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O5 .0641 .2558 .8058 .026001 .030613 .023728 .026926 .005154 -.000525 |
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O6 .2265 .3544 .6779 .006413 .009724 .007651 .004717 -.001085 -.001768 |
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O7 .0620 .1203 .2020 .030852 .020046 .020921 .022640 -.003884 -.007471 |
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O8 .0690 .2625 .2062 .031777 .025311 .022799 .026254 -.003976 .000952 |
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O9 .2239 .3455 .3262 .009995 .014074 .009649 .008193 -.006103 -.004056 |
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Wat1 .3315 .0362 .0078 .057238 .054624 .066070 .045751 -.004058 .001368 |
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Wat2 .3371 .8816 .9908 .061917 .055961 .054355 .048617 -.007065 -.002559 |
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|
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Hilairite |
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Ilyushin G D, Voronkov A A, Nevskii N N, Ilyukhin V V, Belov N V |
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Doklady Akademii Nauk SSSR 260 (1981) 1118-1120 |
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Crystal structure of hilairite, Na2ZrSi3O9*3H2O |
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_database_code_amcsd 0012472 |
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10.556 10.556 15.855 90 90 120 R32 |
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atom x y z occ Biso |
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Na1 0 0 .1970 .800 7.9 |
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Na2 .3888 0 .5 .678 2.6 |
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Zr1 0 0 0 1.19 |
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Zr2 0 0 .5 1.00 |
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Si .4174 .4128 .2486 .72 |
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O1 .0921 .1846 .0768 1.19 |
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O2 .0989 .1902 .5720 1.18 |
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O3 .6539 0 0 1.19 |
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O4 .6434 0 .5 1.22 |
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Wat .5000 .1460 .0630 3.63 |
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|
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Parakeldyshite |
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Voronkov A A, Shumyatskaya N G, Pyatenko Y A |
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Journal of Structural Chemistry 11 (1970) 866-867 |
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Crystal structure of a new natural modification of Na2Zr[Si2O7] |
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Locality: synthetic |
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_database_code_amcsd 0014056 |
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6.66 8.83 5.42 92.75 94.25 72.33 P-1 |
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atom x y z |
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Na1 .874 .099 .264 |
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Na2 .299 .492 .738 |
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Zr .289 .271 .220 |
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Si1 .642 .146 .772 |
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Si2 .935 .336 .689 |
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O1 .296 .037 .176 |
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O2 .884 .169 .745 |
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O3 .497 .206 .524 |
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O4 .557 .252 .023 |
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O5 .002 .316 .395 |
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O6 .123 .340 .886 |
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O7 .300 .520 .230 |
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|
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|
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Vlasovite |
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Voronkov A A, Zhdanova T A, Pyatenko Y A |
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Kristallografiya 19 (1974) 252-259 |
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Refinement of the structure of vlasovite Na2ZrSi4O11 and some characteristics of |
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the composition and structure of the zirconosilicates |
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_database_code_amcsd 0014182 |
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10.98 10.00 8.52 90 100.40 90 C2/c |
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atom x y z Biso |
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Na1 0 .075 .75 3.4 |
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Na2 0 .395 .75 5.1 |
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Zr .25 .25 0 1.9 |
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Si1 .2637 .0722 .6385 1.4 |
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Si2 .0498 .2178 .4272 1.4 |
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O1 0 .160 .25 2.2 |
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O2 .143 .106 .505 2.7 |
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O3 .115 .358 .419 3.1 |
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O4 .056 .230 .971 1.9 |
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O5 .242 .134 .801 2.3 |
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O6 .287 .084 .145 2.3 |
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|
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Tundrite-(Ce) |
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Shumyatskaya N G, Voronkov A A, Ilyukhin V V, Belov N V |
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Soviet Physics - Crystallography 21 (1976) 399-405 |
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Tundrite, Na2Ce2TiO2[SiO4](CO3)2 - |
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refinement of the crystal structure and chemical formula |
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Locality: Khibiny Massif, Kola Peninsula, Russia |
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Note: y(O11) adjusted to match reported bond lengths |
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_database_code_amcsd 0015572 |
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7.560 13.957 5.040 101.12 70.87 100.02 P-1 |
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atom x y z Biso |
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Na1 0 0 .5 1.82 |
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Na2 .1405 .4747 .1748 2.08 |
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Na3 .5 .5 .5 3.26 |
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Ce1 .6565 .7787 .5923 .83 |
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Ce2 .2181 .7776 .3103 1.04 |
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Ti .6100 .9997 .1947 .10 |
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Si .9610 .8578 .9115 .37 |
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C1 .7914 .3534 .2433 1.22 |
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C2 .5993 .6535 .0623 .71 |
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O1 .9335 .7563 .7068 .66 |
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O2 .7925 .9172 .9089 .81 |
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O3 .1613 .9167 .7245 .70 |
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O4 .9563 .8430 .2243 .88 |
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O5 .4053 .9185 .0677 .81 |
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O6 .5504 .9189 .4993 .74 |
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O7 .8735 .3813 .9915 .01 |
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O8 .8096 .4043 .4623 2.41 |
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O9 .3343 .3761 .7702 1.46 |
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O10 .4046 .3923 .1771 1.37 |
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O11 .3076 .7358 .7489 1.24 |
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O12 .5458 .7415 .1339 .91 |
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|
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Sazhinite-(Ce) |
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Shumyatskaya N G, Voronkov A A, Pyatenko Y A |
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Soviet Physics - Crystallography 25 (1980) 419-423 |
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Sazhinite, Na2Ce[Si6O14(OH)]*nH2O: a new representative of the dalyite family in crystal chemistry |
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_database_code_amcsd 0015583 |
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7.50 15.62 7.35 90 90 90 Pmm2 |
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atom x y z Biso |
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Ce1 0 .26 .004 3.55 |
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Si1 .284 .094 .76 3.29 |
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Si2 .298 .402 .295 2.88 |
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Si3 0 .164 .496 4.39 |
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Si4 0 .365 .592 3.74 |
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Na1 .5 .261 .005 3.86 |
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Na2 .222 .5 .875 6.87 |
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O1 .257 0 .823 3.69 |
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O2 .245 .335 .139 5.18 |
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O3 .241 .171 .916 3.58 |
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O4 .192 .114 .565 2.56 |
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O5 .171 .398 .487 5.69 |
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O6 .254 .5 .232 3.95 |
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OH7 0 .189 .276 4.56 |
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O8 0 .259 .604 4.57 |
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O9 0 .392 .789 6.36 |
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O10 .5 .113 .688 4.45 |
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O11 .5 .402 .377 5.18 |
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Wat12 .5 .373 .766 4.22 |
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Wat13 0 0 .138 10.02 |
|
|
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|
| |
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Stillwellite-(Ce) |
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Voronkov A A, Pyatenko Y A |
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Soviet Physics Crystallography 12 (1967) 214-220 |
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X-ray diffraction study of the atomic structure of stillwellite CeBO[SiO4] |
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Locality: Soviet |
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_database_code_amcsd 0018733 |
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6.85 6.85 6.70 90 90 120 P3_1 |
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atom x y z |
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Ce .587 0 0 |
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B .113 0 .973 |
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Si .585 0 .5 |
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O1 .339 .194 .023 |
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O2 .195 .339 .31 |
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O3 .613 .464 .32 |
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O4 .464 .614 .014 |
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O5 .051 .051 .781 |
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|
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|
| |
|
Sidorenkite |
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Kurova T A, Shumyatskaya N G, Voronkov A A, Pyatenko Y A |
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Soviet Physics Doklady 25 (1980) 156-157 |
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Crystal structure of sidorenkite Na3Mn(PO4)(CO3) |
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_database_code_amcsd 0015607 |
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8.997 6.741 5.163 90 90.16 90 P2_1/m |
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atom x y z Biso |
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Na1 .7409 .9978 .7513 1.44 |
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Na2 .0822 .25 .7615 1.88 |
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Mn .3624 .75 .7799 1.00 |
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P .4125 .25 .7011 .55 |
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C .0605 .75 .7345 .76 |
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O1 .1233 .75 .9616 1.37 |
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O2 .1430 .75 .5317 1.30 |
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O3 .9195 .75 .7157 1.48 |
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O4 .3210 .4345 .7817 1.23 |
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O5 .5684 .25 .8260 1.05 |
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O6 .5694 .75 .5965 1.07 |
|
|
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|
| |
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Kostylevite |
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Ilyukhin V V, Khomyakov A P, Shumyatskaya N G, Voronkov A A, Nevskii N N, |
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Belov N V |
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Soviet Physics Doklady 26 (1981) 118-120 |
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The crystal structure of the new natural zirconosilicate K4Zr2Si6O18*2H2O |
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Locality: Khibinsk massif, Kola Peninsula, Russia |
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Note: dimorphic with umbite |
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Note: y(O7) corrected |
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_database_code_amcsd 0015609 |
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6.565 13.171 11.727 90 90 105.26 P2_1/b |
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atom x y z Biso |
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K1 .7950 .0853 .5484 1.78 |
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K2 .6816 .8849 .8831 3.03 |
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Zr .1223 .2205 .7834 .72 |
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Si1 .8438 .1557 .0275 .68 |
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Si2 .5885 .1513 .8132 .64 |
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Si3 .7909 .0181 .2357 .61 |
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O1 .8037 .2003 .7470 1.06 |
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O2 .0573 .1920 .9536 1.24 |
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O3 .4391 .2298 .8145 1.20 |
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O4 .1649 .3775 .8129 1.12 |
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O5 .1943 .2557 .6115 1.20 |
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O6 .0770 .0636 .7326 1.21 |
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O7 .6372 .1188 .9436 1.41 |
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O8 .8495 .0525 .1024 1.38 |
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O9 .4662 .0376 .7568 1.01 |
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Wat .4029 .1243 .4927 2.83 |
|
|
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|
| |
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