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Boussingaultite |
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Montgomery H, Lingafelter E C |
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Acta Crystallographica 17 (1964) 1478-1479 |
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The crystal structure of Tutton's salts. II. |
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Magnesium ammonium sulfate hexahydrate and nickel ammonium sulfate hexahydrate |
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Locality: synthetic |
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_database_code_amcsd 0020241 |
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9.383 12.669 6.220 90 107.05 90 P2_1/a |
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atom x y z |
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N1 .1321 .3509 .3611 |
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H1 .058 .337 .225 |
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H2 .208 .305 .394 |
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H3 .095 .344 .487 |
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Mg 0 0 0 |
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S .0953 -.3605 .2575 |
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O1 -.0469 -.4174 .2116 |
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O2 .2185 -.4328 .3718 |
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O3 .1185 -.3211 .0456 |
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O4 .0951 -.2702 .4089 |
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O5 .1603 -.1094 -.0307 |
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O6 .1685 .1042 .1656 |
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O7 -.0017 -.0687 .2986 |
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H4 .174 .421 .346 |
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H5 .200 .091 .317 |
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H6 .227 .134 .116 |
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H7 -.252 .096 -.059 |
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H8 -.143 .176 .008 |
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H9 -.097 -.066 .341 |
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H10 .027 -.135 .325 |
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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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Boussingaultite |
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Margulis T N, Templeton D H |
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Zeitschrift fur Kristallographie 117 (1962) 344-357 |
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Crystal structure and hydrogen bonding of magnesium ammonium sulfate |
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hexahydrate |
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_database_code_amcsd 0010599 |
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9.324 12.597 6.211 90 107.14 90 P2_1/a |
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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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Mg 0 0 0 .0056 .0032 .0129 -.0004 .00215 -.0001 |
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S .0953 -.3605 .2575 .0056 .0036 .0160 .00035 .0028 .00045 |
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O1 -.0469 -.4174 .2116 .0077 .0071 .033 -.00075 .0025 .0025 |
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O2 .2185 -.4328 .3718 .0071 .0040 .022 .00185 .003 .0015 |
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O3 .1185 -.3211 .0456 .0105 .0043 .016 .0009 .005 .0015 |
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O4 .0951 -.2702 .4089 .0130 .0043 .020 .0012 .005 -.001 |
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O5 .1603 -.1094 -.0307 .0059 .0035 .024 .00055 .003 .001 |
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O6 .1685 .1042 .1656 .0079 .0049 .016 -.00155 .002 -.001 |
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O7 -.0017 -.0687 .2986 .0080 .0034 .017 .0003 .004 .001 |
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N .1321 .3509 .3611 .0100 .0054 .022 -.0003 .006 -.0005 |
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H1 .21 .100 .30 4.0 |
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H2 .02 -.131 .32 4.0 |
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H3 .26 -.090 .05 4.0 |
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H4 .06 .333 .21 4.0 |
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H5 .15 -.178 -.01 4.0 |
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H6 .21 .305 .40 4.0 |
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H7 .17 .422 .36 4.0 |
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H8 .40 -.438 .31 4.0 |
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H9 .23 .120 .10 4.0 |
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H10 .09 .346 .45 4.0 |
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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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