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Fluellite |
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Guy B B, Jeffrey G A |
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American Mineralogist 51 (1966) 1579-1592 |
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The crystal structure of fluellite, Al2PO4F2(OH).7H2O |
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8.546 11.222 21.158 90 90 90 *Fddd |
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.125 .125 .125 |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Al 0 0 0 .000205 .000754 .000262 -.000182 .000028 -.000105 |
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P .125 .125 .125 .000787 .001032 .000313 0 0 0 |
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O1 .1812 .9071 .0033 .003423 .001866 .000670 .001199 -.000124 -.000179 |
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O2 .0220 .0457 .0834 .001746 .002005 .000374 -.000130 -.000097 .000358 |
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O3 .2415 .9986 .8414 .003731 .004328 .001011 -.001408 .000304 .000168 |
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F .125 .125 .2767 .000240 .001846 .000408 .001747 0 0 |
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H1 .166 .993 .874 .006162 .003573 .001005 .000000 .000000 .000000 |
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H2 .28 .06 .25 .81 |
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H3 .29 .10 .78 .75 |
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H4 .22 .94 .81 .25 |
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H5 .21 .90 .78 .75 |
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H6 .34 .96 .14 .50 |
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H7 .28 .96 0 .25 |
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