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Bischofite |
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Agron P A, Busing W R |
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Acta Crystallographica C41 (1985) 8-10 |
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Magnesium dichloride hexahydrate, MgCl2*6H2O, by neutron diffraction |
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Locality: synthetic |
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9.8607 7.1071 6.0737 90 93.758 90 C2/m |
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atom x y z Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Mg 0 0 0 2.0 .0226 .0295 .0245 0 .0018 0 |
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Cl .3176 0 .6122 2.8 .0312 .0407 .0359 0 .0052 0 |
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O1 .2019 0 .1095 3.5 .0256 .0689 .0379 0 -.0017 0 |
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O2 -.0429 .2067 .2233 3.9 .0453 .0497 .0538 -.0100 .0196 -.0231 |
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H1 .2372 0 .2583 5.0 .0486 .0861 .0527 0 -.0117 0 |
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H2 .2693 0 .0083 7.0 .0448 .1418 .0801 0 .0178 0 |
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H3 .0209 .2997 .2784 4.5 .0661 .0490 .0559 -.0065 .0017 -.0144 |
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H4 -.1161 .1984 .3151 5.9 .0647 .0947 .0702 .0032 .0319 -.0164 |
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Antarcticite |
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Agron P A, Busing W R |
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Acta Crystallographica C42 (1986) 141-143 |
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Calcium and strontium dichloride hexahydrates by neutron diffraction |
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7.8759 7.8758 3.9545 90 90 120 P321 |
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atom x y z Biso |
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Ca 0 0 0 1.41 |
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Cl .3333 .6667 .4249 2.16 |
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O1 .3114 0 0 2.26 |
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O2 -.2132 0 .5000 1.94 |
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H1 .4326 .0988 -.0926 4.13 |
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H2 -.2330 .1113 .4835 3.58 |
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| Download AMC data (View Text File)
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SrCl2*6H2O |
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Agron P A, Busing W R |
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Acta Crystallographica C42 (1986) 141-143 |
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Calcium and strontium dichloride hexahydrates by neutron diffraction |
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7.9596 7.9596 4.1243 90 90 120 P321 |
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atom x y z Biso |
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Sr 0 0 0 1.34 |
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Cl .3333 .6667 .4190 2.44 |
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O1 .3229 0 0 2.57 |
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O2 -.2219 0 .5000 1.94 |
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H1 .4419 .0964 -.0899 4.51 |
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H2 -.2415 .1103 .4887 3.50 |
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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
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