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Alluaivite |
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Rastsvetaeva R K, Khomyakov A P, Andrianov V I, Gusev A I |
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Doklady Akademii Nauk SSSR 312 (1990) 1379-1383 |
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Crystal structure of alluaivite |
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Note: eudialyte-type structure |
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_database_code_amcsd 0012482 |
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14.046 14.046 60.600 90 90 120 R-3m |
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atom x y z occ Biso |
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Na1 .4864 .2432 .4820 3.0 |
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Na2 .5574 .4426 .4090 3.5 |
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Na3 .2360 .1180 .3622 2.9 |
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Na4 .2246 .4492 .3351 .78 3.6 |
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Na5 .4140 .5860 .4221 .97 6.9 |
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Na6 .1043 .5522 .0894 .90 3.1 |
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Na7 1/3 1/6 1/6 3.0 |
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Na8 .5 .5 0 .22 5.3 |
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Ca1 .7376 0 0 .75 .63 |
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Ca2 .7396 .7396 .5 .75 .68 |
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Mn1 .7376 0 0 .25 .63 |
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Mn2 .7396 .7396 .5 .25 .68 |
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Nb1 .3419 .1710 .4163 .23 1.31 |
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K2 0 0 .5 .33 4.8 |
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Ce3 .4140 .5860 .4221 .03 6.9 |
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Sr4 .1043 .5522 .0894 .10 3.1 |
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Ti3 .3419 .1710 .4163 .77 1.31 |
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Si1 .2063 .4127 .4608 .97 |
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Si2 .5249 .2625 .3735 1.32 |
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Si3 .0848 .5424 .3712 1.04 |
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Si4 .4047 .5953 .2095 .94 |
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Si5 .3496 .2847 .2157 .94 |
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Si6 .0625 .3426 .2842 1.22 |
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Si7 1/3 2/3 .3781 1.20 |
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Si8 1/3 2/3 .4715 1.80 |
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O1 .1717 .3434 .3914 1.7 |
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O2 .0258 .5130 .3481 1.7 |
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O3 .5527 .4473 .3124 2.5 |
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O4 .1825 .3651 .4848 1.3 |
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O5 .4433 .5567 .2307 2.5 |
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O6 .4738 .2369 .3982 2.2 |
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O7 .0623 .1247 .4543 1.9 |
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O8 .4895 .0210 .4442 1.4 |
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O9 .6038 .3962 .3720 2.0 |
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O10 .4313 .5687 .1862 2.5 |
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O11 .3919 .6081 .3672 7.7 |
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O12 .2691 .0390 .3980 1.9 |
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O13 .2781 .3745 .4458 1.9 |
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O14 .0729 .7026 .3097 1.7 |
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O15 .6897 .6147 .1907 1.6 |
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O16 .0542 .4395 .3877 2.8 |
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O17 .4424 .3594 .2333 1.8 |
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O18 .2734 .5467 .4591 2.6 |
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O19 1/3 2/3 .4041 1.5 |
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O20 1/3 2/3 .4964 3.6 |
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Wat21 0 0 .5 .67 4.8 |
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Wat22 2/3 1/3 .4483 10 |
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Wat23 1/3 2/3 .0500 .20 3.3 |
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Cl 0 0 .3543 .80 2.3 |
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Volkovskite |
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Rastsvetaeva R K, Andrianov V I, Genkina E A, Sokolova T N, Kashaev A A |
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Kristallografiya 37 (1992) 326-333 |
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Crystal structure of volkovskite KCa4B22O32(OH)10Cl*4H2O from Nepkii deposit (E. Siberia) |
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Locality: Eastern Siberia |
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_database_code_amcsd 0014191 |
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6.50 23.96 6.62 95.68 119.6 90.59 P1 |
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atom x y z Biso |
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K .0227 .0230 .0367 3.58 |
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Ca1 .8140 .1653 .6591 2.70 |
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Ca2 .7182 .5818 .3904 2.53 |
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Ca3 .4972 .9070 .0221 2.60 |
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Ca4 .1926 .4890 .3451 2.48 |
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B1 .042 .6116 .082 2.5 |
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B2 .991 .8903 .108 2.5 |
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B3 .303 .5999 .903 2.5 |
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B4 .395 .9171 .427 2.4 |
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B5 .767 .4715 .840 2.4 |
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B6 .401 .1609 .155 2.5 |
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B7 .241 .2651 .562 3.3 |
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B8 .709 .1544 .058 2.5 |
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B9 .221 .6127 .508 2.5 |
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B10 .164 .7010 .331 3.1 |
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B11 .573 .3701 .172 3.0 |
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B12 .081 .4806 .748 2.5 |
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B13 .872 .8044 .820 3.2 |
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B14 .497 .4596 .006 2.6 |
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B15 .138 .1719 .336 2.8 |
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B16 .612 .5905 .803 2.4 |
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B17 .840 .2894 .748 3.0 |
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B18 .317 .1791 .763 2.6 |
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B19 .813 .8979 .686 2.7 |
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B20 .456 .7827 .983 3.1 |
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B21 .678 .4582 .433 2.6 |
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B22 .081 .9106 .519 2.3 |
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O1 .139 .1532 .539 2.5 |
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O2 .818 .9152 .905 2.6 |
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O3 .036 .9164 .702 2.8 |
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O4 .042 .5874 .280 2.5 |
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O5 .918 .4879 .523 2.6 |
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O6 .604 .4678 .610 2.5 |
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O7 .141 .6033 .676 2.5 |
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O9 .838 .5891 .856 2.6 |
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O10 .541 .5987 .969 2.6 |
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O11 .321 .9156 .591 2.7 |
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O12 .245 .1670 .934 2.8 |
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O13 .036 .6730 .111 2.7 |
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O14 .784 .8357 .639 2.9 |
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O16 .233 .9143 .195 2.7 |
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O17 .723 .4752 .020 2.6 |
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O18 .352 .1559 .333 2.8 |
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O19 .274 .6724 .523 2.9 |
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O20 .445 .5829 .571 2.5 |
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O21 .622 .9214 .487 2.7 |
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O22 .512 .4837 .227 2.6 |
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O23 .008 .4723 .908 2.5 |
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O24 .641 .1587 .227 2.6 |
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O25 .920 .9014 .290 2.7 |
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O27 .254 .5960 .078 2.5 |
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O28 -.018 .8283 .049 2.9 |
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O30 .555 .1579 .831 2.7 |
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O31 .936 .1462 .114 2.5 |
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O32 .130 .2341 .347 2.8 |
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O33 .337 .2413 .763 3.2 |
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O34 .701 .3982 .390 2.8 |
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O37 .307 .4812 .801 2.6 |
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O42 .461 .3974 .976 2.8 |
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OH8 .903 .2542 .912 3.4 |
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OH15 .533 .8172 .183 3.4 |
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OH26 .369 .8120 .796 3.6 |
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OH29 .571 .3126 .159 3.9 |
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OH35 .860 .7473 .772 4.0 |
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OH36 .244 .3229 .565 3.9 |
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OH38 .737 .2598 .531 3.6 |
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OH40 .866 .3462 .791 4.0 |
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OH41 .187 .7581 .373 4.0 |
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OH45 .467 .7261 .973 4.2 |
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Cl .5288 .0224 .0627 3.46 |
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Wat39 .717 .6778 .386 3.8 |
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Wat43 .736 .0655 .601 3.7 |
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Wat44 .276 .0422 .523 4.6 |
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Wat46 .138 .3936 .249 3.8 |
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H1 -.01 .243 .05 3.4 |
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H2 .61 .813 .34 3.4 |
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H3 .30 .795 .63 3.6 |
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H4 .48 .289 .02 3.9 |
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H5 .93 .726 .88 4. |
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H6 .31 .348 .71 3.9 |
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H7 .68 .276 .40 3.6 |
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H8 .78 .355 .65 4. |
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H9 .09 .777 .27 4. |
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H10 .39 .709 .81 4.2 |
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H11 .78 .699 .53 3.8 |
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H12 .65 .684 .25 3.8 |
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H13 .58 .058 .57 3.7 |
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H14 .68 .051 .43 3.7 |
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H15 .22 .077 .63 4.6 |
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H16 .33 .027 .67 4.6 |
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H17 .21 .370 .38 3.8 |
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H18 .05 .377 .09 3.8 |
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|
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View JMOL 3-D Structure
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Murmanite |
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Rastsvetaeva R K, Andrianov V I |
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Soviet Physics - Crystallography 31 (1986) 44-48 |
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New data on the crystal structure of murmanite |
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_database_code_amcsd 0015586 |
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8.700 8.728 11.688 94.31 98.62 105.62 P1 |
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atom x y z occ Biso |
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Na1 .905 .303 .988 .5 .10 |
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Na2 .069 .682 .974 .5 .63 |
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Na3 .381 .805 .004 .5 1.97 |
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Na4 .552 .174 .986 .5 .75 |
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Na5 .983 .177 .272 .3 1.37 |
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Mn2+5 .983 .177 .272 .45 1.37 |
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Zr5 .983 .177 .272 .25 1.37 |
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Na6 .492 .313 .696 .4 1.95 |
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Ca6 .492 .313 .696 .6 1.95 |
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Na7 .985 .809 .705 .8 2.39 |
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K7 .985 .809 .705 .2 2.39 |
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Na8 .480 .673 .272 3.73 |
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Ti1 .683 .551 .994 .85 1.10 |
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Fe3+1 .683 .551 .994 .15 1.10 |
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Ti2 .165 .069 .001 .85 1.28 |
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Fe3+2 .165 .069 .001 .15 1.28 |
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Ti3 .316 .445 .981 .85 1.41 |
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Fe3+3 .316 .445 .981 .15 1.41 |
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Ti4 .800 .940 .983 .85 1.26 |
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Fe3+4 .800 .940 .983 .15 1.26 |
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Ti5 .743 .068 .721 .8 1.87 |
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Nb5 .743 .068 .721 .2 1.87 |
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Ti6 .248 .568 .717 .8 2.16 |
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Nb6 .248 .568 .717 .2 2.16 |
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Ti7 .220 .950 .271 .8 1.09 |
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Nb7 .220 .950 .271 .2 1.09 |
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Ti8 .754 .414 .258 .8 .82 |
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Nb8 .754 .414 .258 .2 .82 |
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Si1 .142 .187 .742 1.64 |
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Si2 .647 .687 .742 1.57 |
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Si3 .143 .537 .222 1.53 |
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Si4 .823 .798 .228 1.28 |
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Si5 .613 .009 .215 .96 |
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Si6 .356 .328 .228 1.01 |
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Si7 .344 .965 .766 1.89 |
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Si8 .852 .466 .753 2.09 |
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O1 .317 .284 .088 1.54 |
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O2 .815 .764 .096 1.51 |
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O3 .984 .942 .277 1.12 |
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O4 .146 .506 .077 2.45 |
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O5 .606 .967 .070 1.77 |
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O6 .730 .411 .103 2.74 |
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O7 .197 .936 .114 1.45 |
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O8 .431 .004 .272 .47 |
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O9 .225 .686 .265 2.94 |
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O10 .756 .187 .254 .70 |
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O11 .973 .100 .088 2.02 |
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O12 .992 .899 .924 2.30 |
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O13 .491 .612 .074 2.13 |
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O14 .305 .491 .265 .85 |
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O15 .522 .377 .290 1.57 |
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O16 .686 .876 .275 2.29 |
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O17 .231 .193 .289 .49 |
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O18 .508 .395 .907 2.07 |
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O19 .809 .639 .292 .82 |
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O20 .159 .243 .893 1.59 |
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O21 .224 .328 .696 3.85 |
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O22 .993 .416 .247 1.53 |
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O23 .517 .051 .718 3.69 |
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O24 .014 .540 .725 4.30 |
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O25 .270 .581 .879 1.47 |
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O26 .692 .852 .697 4.28 |
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O27 .771 .083 .892 3.15 |
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O28 .211 .026 .714 3.86 |
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O29 .502 .549 .711 3.48 |
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O30 .947 .141 .712 2.16 |
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O31 .673 .733 .906 2.28 |
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O32 .342 .995 .915 2.43 |
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O33 .856 .505 .899 1.98 |
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O34 .315 .769 .722 1.94 |
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O35 .816 .634 .726 2.72 |
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O36 .817 .274 .721 3.06 |
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Wat1 .249 .982 .459 3.16 |
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Wat2 .775 .446 .460 2.59 |
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Wat3 .998 .230 .453 3.73 |
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Wat4 .473 .767 .451 1.95 |
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Wat5 .988 .762 .521 4.12 |
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Wat6 .500 .255 .505 2.80 |
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Wat7 .691 .054 .534 3.34 |
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Wat8 .208 .547 .536 2.97 |
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|
| Download AMC data (View Text File)
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Grumantite |
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Yamnova N Y, Pushcharovsky D Y, Andrianov V I, Rastsvetaeva R K, |
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Khomyakov A P, Mikheeva M G |
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Soviet Physics Doklady 34 (1989) 284-286 |
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A new type of silicon-oxygen group in the structure of grumantite |
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Na[Si2O4(OH)]*H2O |
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Locality: Lovozero massif, Kola Peninsula, Russia |
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_database_code_amcsd 0015617 |
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15.979 18.25 7.169 90 90 90 Fdd2 |
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atom x y z Biso |
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Na .1382 .2385 .8868 1.44 |
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Si1 .1030 .2258 .3753 .56 |
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Si2 .2241 .0907 .3719 .51 |
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O1 .1691 .1618 .4289 1.06 |
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O2 .1589 .0243 .3149 .81 |
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O4 .0413 .1452 .9666 .90 |
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O6 .0140 .1873 .3233 .78 |
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Oh5 .1183 .0253 .9513 1.17 |
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Ow3 .0079 .0843 .6276 1.49 |
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H1 .015 .112 .72 1.5 |
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H2 .010 .120 .54 1.5 |
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H3 .095 .071 .97 1.5 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Sitinakite |
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Sokolova E V, Rastsvetaeva R K, Andrianov V I, Egorov-Tismenko Y K, |
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Men'shikov Y P |
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Soviet Physics Doklady 34 (1989) 583-585 |
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Locality: Khibinskii alkaline massif, Russia |
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The crystal structure of a new sodium titanosilicate |
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_database_code_amcsd 0015618 |
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7.819 7.819 12.099 90 90 90 P4_2/mcm |
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atom x y z occ Biso |
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Na 0 .5 0 3.3 |
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K1 .398 .398 .5 .1925 5.1 |
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K2 .463 .463 .372 .0763 6.7 |
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Ti .1387 .1387 .6535 .95 .62 |
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NbTi .1387 .1387 .6535 .05 .62 |
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Si 0 .5 .25 1.04 |
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O2 .1426 .1426 .5 1.0 |
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O3 .1142 .1142 .1723 1.2 |
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O4 .1195 .3828 .6700 1.3 |
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Wat1 .269 .269 0 3.4 |
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Wat5 .5 .5 .25 .82 4.7 |
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Wat6 .5 .5 .31 .1 6.6 |
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Wat7 .478 .478 .421 .0988 6.4 |
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Wat8 .42 .42 .161 .0688 4.4 |
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Na8 .42 .42 .161 .0275 4.4 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Hsianghualite |
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Rastsvetaeva R K, Rekhlova O Y, Andrianov V I, Malinovskii Y A |
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Soviet Physics Doklady 36 (1991) 11-13 |
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Crystal structure of hsianghualite |
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Locality: China |
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_database_code_amcsd 0015620 |
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12.864 12.864 12.864 90 90 90 I2_13 |
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atom x y z Biso |
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Li1 .4769 .4769 .4769 1.9 |
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Li2 .2296 .2296 .2296 2.6 |
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Ca1 .0863 0 .25 1.83 |
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Ca2 .5 .25 .3445 1.89 |
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Be .3708 .3296 .0935 1.9 |
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Si .1239 .1553 .4203 1.67 |
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O1 .1034 .3934 .0121 1.81 |
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O2 .0674 .3824 .2077 1.78 |
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O3 .3584 .1495 .2620 1.86 |
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O4 .3670 .1824 .4573 1.90 |
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F1 .3954 .3954 .3954 2.2 |
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F2 .1454 .1454 .1454 2.1 |
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|
| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
|
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