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Metavariscite |
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Kniep R, Mootz D |
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Acta Crystallographica B29 (1973) 2292-2294 |
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Metavariscite - A redetermination of its crystal structure |
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Locality: Utalith Hill, Lucin, Utah, USA |
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_database_code_amcsd 0009488 |
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5.178 9.514 8.454 90 90.35 90 P2_1/n |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Al .40309 .32545 .30626 .003543 .001326 .001189 .000000 .000000 .000031 |
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P -.09105 .14688 .18371 .002984 .001050 .000944 .000051 .000000 -.000062 |
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O1 .16505 .17902 .27036 .005595 .002044 .003253 -.000304 -.001314 -.000186 |
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O2 -.09291 .21677 .02094 .011842 .002292 .001539 .000000 .000400 .000218 |
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O3 -.31481 .20439 .28127 .006434 .002790 .002414 .001218 .001256 -.000124 |
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O4 -.11458 -.01392 .17227 .005595 .001353 .003148 -.000051 -.000457 -.000093 |
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OW1 .11617 .44767 .32202 .005315 .002210 .009060 .000152 .000914 .000964 |
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OW2 .40410 .36239 .07903 .013521 .004391 .002134 -.001522 -.000800 -.000062 |
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H11 .139 .530 .288 .013987 .001933 .015042 -.003045 -.002285 .001865 |
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H12 -.037 .432 .331 .013987 .011048 .024836 .012180 -.000914 .000000 |
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H21 .274 .334 .023 .023312 .042258 .005947 .018777 .010851 .013987 |
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H22 .539 .369 .023 .054083 .048334 .004897 .047196 .006282 .007149 |
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Variscite |
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Kniep R, Mootz D, Vegas A |
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Acta Crystallographica B33 (1977) 263-265 |
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Variscite |
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Locality: Montgomery County, Arkansas, USA |
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_database_code_amcsd 0009582 |
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9.822 8.561 9.630 90 90 90 Pbca |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Al .13389 .15500 .16841 .001140 .001706 .001159 -.000030 -.000026 -.000152 |
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P .14779 .46844 .35284 .001062 .001501 .001024 -.000059 .000026 .000030 |
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O1 .11180 .29870 .31525 .002229 .001706 .001644 -.000446 .000291 -.000576 |
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O2 .04030 .58186 .29453 .001451 .003241 .001968 .000565 .000185 .000788 |
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O3 .28545 .51247 .29006 .001425 .002524 .001914 -.000089 .000449 .000667 |
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O4 .14997 .47916 .51224 .002125 .002013 .001240 -.000059 .000000 .000243 |
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OW1 .06041 .32564 .0546 .002954 .003957 .001725 .000892 -.000264 -.000212 |
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OW2 .30726 .23597 .11499 .001840 .002661 .002561 -.000357 -.000211 .000485 |
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H11 .063 .310 -.028 3.8 |
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H12 -.012 .371 .068 4.0 |
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H21 .362 .201 .168 2.0 |
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H22 .314 .334 .085 4.7 |
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Ottemannite |
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Kniep R, Mootz D, Severin U, Wunderlich H |
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Acta Crystallographica B38 (1982) 2022-2023 |
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Structure of tin(II) tin(IV) trisulphide, a redetermination |
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Locality: synthetic |
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_database_code_amcsd 0009775 |
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8.878 3.751 14.020 90 90 90 Pnma |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Sn1 .16494 .25 .05195 .002950 .012793 .001335 0 -.000362 0 |
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Sn2 .48509 .75 .16936 .003838 .019545 .002429 0 -.000066 0 |
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S1 -.01953 .75 .10640 .003045 .015991 .001068 0 .000000 0 |
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S2 .33879 .75 -.00476 .002886 .016702 .001386 0 .000141 0 |
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S3 .28631 .25 .21246 .004282 .017591 .001386 0 -.000422 0 |
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FSO2(OH) |
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Bartmann K, Mootz D |
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Acta Crystallographica C46 (1990) 319-320 |
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Structures of two strong Bronsted acids: (I) fluorosulfuric |
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acid and (II) trifluoromethanesulfonic acid |
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Sample: T = 123 K |
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_database_code_amcsd 0010101 |
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4.868 6.736 9.359 90 90 90 P2_12_12_1 |
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atom x y z Uiso |
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S -.16332 .52793 .91081 .0127 |
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F .1452 .5013 .8797 .0247 |
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O1 -.2863 .3830 .8044 .0192 |
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O2 -.2080 .4484 .0494 .0225 |
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O3 -.2270 .7279 .8798 .0210 |
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H -.299 .421 .744 .059 |
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CF3SO2(OH) |
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Bartmann K, Mootz D |
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Acta Crystallographica C46 (1990) 319-320 |
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Structures of two strong Bronsted acids: (I) fluorosulfuric |
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acid and (II) trifluoromethanesulfonic acid |
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Sample: T = 173 K |
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_database_code_amcsd 0010102 |
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4.947 11.260 8.457 90 99.21 90 P2_1/n |
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atom x y z Uiso |
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S .06158 .70125 .26377 .0204 |
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F1 -.2110 .5293 .3658 .0416 |
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F2 -.2832 .5520 .1110 .0474 |
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F3 .0916 .4728 .2266 .0473 |
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O1 .1697 .7149 .1046 .0283 |
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O2 .2940 .6878 .3862 .0345 |
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O3 -.1487 .7834 .2792 .0329 |
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C -.0954 .5534 .2397 .0271 |
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H .049 .760 .021 .096 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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