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Yugawaralite |
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Artioli G, Stahl K, Cruciani G, Gualtieri A, Hanson J C |
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American Mineralogist 86 (2001) 185-192 |
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In situ dehydration of yugawaralite |
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Sample: at T = 315 K |
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_database_code_amcsd 0002627 |
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6.73200 14.0157 10.0607 90 111.189 90 Pc |
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atom x y z occ Uiso |
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Si1 .338 .1498 .984 .0049 |
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Si2 .704 .0352 .192 .0049 |
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Si3 .407 .1250 .697 .0049 |
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Si4 .019 .4750 .438 .0049 |
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Si5 .354 .3718 .962 .0049 |
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Si6 .736 .5005 .6260 .0049 |
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Al1 0 .0062 0 .0049 |
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Al2 .389 .3555 .652 .0049 |
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O1 .102 .1053 .943 .007 |
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O2 .848 .046 .095 .007 |
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O3 .187 .078 .593 .007 |
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O4 .514 .113 .133 .007 |
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O5 .429 .125 .861 .007 |
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O6 .615 .0730 .687 .007 |
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O7 .853 .0613 .353 .007 |
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O8 .334 .2634 .008 .007 |
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O9 .408 .2329 .643 .007 |
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O10 .159 .4283 .986 .007 |
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O11 .832 .482 .502 .007 |
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O12 .162 .3808 .503 .007 |
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O13 .576 .4086 .082 .007 |
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O14 .360 .392 .807 .007 |
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O15 .624 .4022 .645 .007 |
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O16 .935 .467 .266 .007 |
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Ca .041 .2169 .424 .012 |
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OW1 .985 .250 .177 .86 .020 |
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OW1a .04 .29 .21 .14 .020 |
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OW2 .897 .234 .620 .020 |
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OW3 .676 .284 .334 .020 |
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OW4 .341 .150 .351 .88 .020 |
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OW4a .32 .13 .28 .12 .020 |
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OW5 .793 .259 .912 .29 .020 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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Yugawaralite |
|
Artioli G, Stahl K, Cruciani G, Gualtieri A, Hanson J C |
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American Mineralogist 86 (2001) 185-192 |
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In situ dehydration of yugawaralite |
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Sample: at T = 454 K |
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_database_code_amcsd 0002628 |
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6.75075 14.0285 10.0289 90 111.216 90 Pc |
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atom x y z occ Uiso |
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Si1 .336 .1480 .980 .0089 |
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Si2 .706 .0353 .190 .0089 |
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Si3 .408 .1281 .690 .0089 |
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Si4 .019 .4764 .440 .0089 |
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Si5 .353 .3715 .961 .0089 |
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Si6 .730 .5034 .6232 .0089 |
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Al1 0 .0036 0 .0089 |
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Al2 .381 .3541 .647 .0089 |
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O1 .103 .103 .946 .015 |
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O2 .853 .050 .096 .015 |
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O3 .192 .080 .585 .015 |
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O4 .516 .112 .127 .015 |
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O5 .422 .128 .853 .015 |
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O6 .608 .0713 .677 .015 |
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O7 .848 .0635 .353 .015 |
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O8 .325 .2620 -.001 .015 |
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O9 .401 .2328 .623 .015 |
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O10 .158 .4268 .984 .015 |
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O11 .828 .486 .500 .015 |
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O12 .149 .3798 .504 .015 |
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O13 .579 .4038 .079 .015 |
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O14 .360 .390 .805 .015 |
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O15 .605 .4072 .634 .015 |
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O16 .918 .462 .268 .015 |
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Ca .011 .2214 .445 .026 |
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OW1 .059 .235 .219 .99 .059 |
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OW1a .0050 .3430 .1970 .01 .059 |
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OW2 .867 .231 .618 .059 |
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OW3 .664 .281 .331 .059 |
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OW4 .3050 .1520 .330 .11 .059 |
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OW4a .33 .087 .30 .20 .059 |
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OW5 .835 .231 .954 .38 .059 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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|
Yugawaralite |
|
Artioli G, Stahl K, Cruciani G, Gualtieri A, Hanson J C |
|
American Mineralogist 86 (2001) 185-192 |
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In situ dehydration of yugawaralite |
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Sample: at T = 581 K |
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_database_code_amcsd 0002629 |
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6.7836 13.9842 10.0736 90 111.443 90 Pc |
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atom x y z occ Uiso |
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Si1 .337 .1503 .986 .0168 |
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Si2 .707 .0324 .194 .0168 |
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Si3 .405 .1267 .694 .0168 |
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Si4 .021 .4717 .462 .0168 |
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Si5 .357 .3693 .965 .0168 |
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Si6 .730 .5056 .645 .0168 |
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Al1 0 -.0022 0 .0168 |
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Al2 .385 .3548 .652 .0168 |
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O1 .112 .101 .965 .027 |
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O2 .835 .034 .087 .027 |
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O3 .172 .092 .593 .027 |
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O4 .531 .114 .126 .027 |
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O5 .414 .132 .855 .027 |
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O6 .611 .0743 .683 .027 |
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O7 .874 .067 .346 .027 |
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O8 .330 .2632 .019 .027 |
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O9 .425 .2333 .640 .027 |
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O10 .175 .437 .983 .027 |
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O11 .845 .492 .532 .027 |
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O12 .157 .3741 .504 .027 |
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O13 .567 .405 .093 .027 |
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O14 .364 .391 .811 .027 |
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O15 .611 .405 .639 .027 |
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O16 .902 .456 .293 .027 |
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Ca .034 .2224 .434 .033 |
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OW1 .060 .242 .202 .128 |
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OW2 .814 .235 .557 .128 |
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OW3 .674 .264 .374 .53 .128 |
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OW4a .33 .100 .27 .31 .128 |
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OW5 .87 .22 .99 .23 .128 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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Yugawaralite |
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Kvick A, Artioli G, Smith J V |
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Zeitschrift fur Kristallographie 174 (1986) 265-281 |
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Neutron diffraction study of the zeolite yugawaralite at 13 K |
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Locality: Hvalfjordur, Iceland |
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Sample: T = 13 K |
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_database_code_amcsd 0010958 |
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6.700 13.972 10.039 90 111.07 90 Pc |
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atom x y z occ Uiso |
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Ca .05134 .21654 .42364 .075 |
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Al1 0 .00710 0 .052 |
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Al2 .39614 .35598 .65361 .051 |
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Si1 .34121 .14798 .98083 .056 |
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Si2 .71051 .03650 .19124 .057 |
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Si3 .40911 .12450 .69431 .053 |
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Si4 .02736 .47598 .43748 .053 |
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Si5 .36039 .37327 .96046 .055 |
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Si6 .74211 .49757 .62097 .055 |
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O1 .10689 .10638 .94844 .083 |
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O2 .85591 .04834 .09817 .086 |
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O3 .19153 .07642 .59056 .078 |
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O4 .50365 .10778 .13425 .072 |
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O5 .43489 .11736 .86004 .091 |
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O6 .61915 .07317 .67971 .076 |
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O7 .84451 .06416 .35574 .075 |
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O8 .33904 .26252 -.00394 .090 |
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O9 .39913 .23277 .63939 .077 |
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O10 .16380 .42664 .98834 .077 |
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O11 .83032 .48293 .49303 .079 |
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O12 .17154 .38236 .49904 .073 |
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O13 .57911 .41154 .08345 .078 |
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O14 .36053 .39320 .80583 .083 |
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O15 .62998 .40026 .64000 .078 |
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O16 .93634 .47014 .26478 .071 |
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Ow1 .98759 .24929 .17041 .744 .111 |
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Ow1a .04165 .27602 .20621 .182 .219 |
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H11 .95821 .19582 .10667 .825 .195 |
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H12 .03505 .30007 .12817 .883 .212 |
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H13 .05910 .34986 .21315 .157 .238 |
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Ow2 .90310 .23331 .61844 .106 |
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H21 .87938 .18305 .67456 .203 |
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H22 .81676 .28638 .62799 .173 |
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Ow3 .70811 .29016 .32835 .978 .109 |
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H31 .59175 .27280 .34773 .482 .195 |
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H32 .65286 .33338 .39098 .417 .207 |
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H33 .66062 .32229 .23748 .171 |
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Ow4 .36920 .15938 .36919 .887 .125 |
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Ow4a .33283 .12668 .35814 .128 .131 |
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H41 .39007 .14373 .28329 .910 .178 |
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H42 .49359 .13517 .44553 .704 .191 |
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H43 .45146 .15376 .40785 .314 .450 |
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Ow5 .81646 .25961 .92491 .119 .134 |
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H51 .90889 .20607 .91977 .098 .134 |
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H52 .87863 .31721 .90312 .119 .249 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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