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Paranatrolite |
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Lee Y, Hriljac J A, Parise J B, Vogt T, |
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American Mineralogist 90 (2005) 252-257 |
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Pressure-induced stabilization of ordered paranatrolite: A new |
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insight into the paranatrolite controversy |
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Sample: at P = 0.99 GPa |
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_database_code_amcsd 0003732 |
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6.4800 19.293 9.8984 90 107.56 90 Cc |
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atom x y z Uiso |
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Si1 .500 .3746 .000 .013 |
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Si2 .195 .3322 .181 .013 |
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Si3 .544 .0802 .314 .013 |
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Al1 .936 .4645 .093 .013 |
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Al2 .346 .2154 .402 .013 |
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O1 .509 .0295 .436 .013 |
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O2 .492 .0485 .159 .013 |
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O3 .408 .1527 .293 .013 |
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O4 .099 .1947 .442 .013 |
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O5 .308 .2987 .336 .013 |
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O6 .063 .2784 .059 .013 |
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O7 .416 .3498 .134 .013 |
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O8 .086 .4052 .224 .013 |
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O9 .801 .1046 .355 .013 |
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O10 .655 .4441 .040 .013 |
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Na1A .180 .1587 .044 .013 |
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Na1B .587 .0998 -.053 .013 |
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Wat2A .140 .0533 -.146 .013 |
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Wat1A .932 .0743 .115 .013 |
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Wat1B .368 .1905 -.098 .013 |
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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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Paranatrolite |
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Lee Y, Hriljac J A, Parise J B, Vogt T |
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American Mineralogist 91 (2006) 247-251 |
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Pressure-induced hydration in zeolite tetranatrolite |
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Locality: Mt. Saint-Hilaire, Quebec, Canada |
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Note: P = 0.4 GPa |
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_database_code_amcsd 0004007 |
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6.580 19.002 9.936 90 108.97 90 Cc |
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atom x y z occ Uiso |
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Na1 .163 .142 .028 .731 .048 |
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Ca1 .163 .142 .028 .237 .048 |
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Na2 .563 .076 -.077 .731 .048 |
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Ca2 .563 .076 -.077 .237 .048 |
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Si1 .500 .3756 .000 .537 .024 |
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Al1 .500 .3756 .000 .463 .024 |
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Si2 .1979 .3353 .1845 .537 .024 |
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Al2 .1979 .3353 .1845 .463 .024 |
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Si3 .5491 .0853 .3195 .537 .024 |
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Al3 .5491 .0853 .3195 .463 .024 |
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Si4 .9341 .4631 .0918 .537 .024 |
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Al4 .9341 .4631 .0918 .463 .024 |
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Si5 .3498 .2192 .4061 .537 .024 |
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Al5 .3498 .2192 .4061 .463 .024 |
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O1 .520 .036 .450 .048 |
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O2 .458 .043 .164 .048 |
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O3 .409 .160 .303 .048 |
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O4 .144 .191 .462 .048 |
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O5 .305 .299 .345 .048 |
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O6 .056 .278 .064 .048 |
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O7 .409 .361 .134 .048 |
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O8 .060 .404 .210 .048 |
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O9 .805 .107 .347 .048 |
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O10 .668 .446 .034 .048 |
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Wat1 -.050 .064 -.182 .048 |
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Wat2 .933 .063 .149 .048 |
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Wat3 .387 .185 -.056 .048 |
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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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Paranatrolite |
|
Lee Y, Hriljac J A, Parise J B, Vogt T |
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American Mineralogist 91 (2006) 247-251 |
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Pressure-induced hydration in zeolite tetranatrolite |
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Locality: Mt. Saint-Hilaire, Quebec, Canada |
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Note: P = 0.8 GPa |
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_database_code_amcsd 0004008 |
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6.567 18.963 9.975 90 108.49 90 Cc |
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atom x y z occ Uiso |
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Na1 .156 .135 .021 .731 .039 |
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Ca1 .156 .135 .021 .237 .039 |
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Na2 .570 .083 -.070 .731 .039 |
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Ca2 .570 .083 -.070 .237 .039 |
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Si1 .500 .3756 0 .537 .016 |
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Al1 .500 .3756 0 .463 .016 |
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Si2 .2000 .3373 .1865 .537 .016 |
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Al2 .2000 .3373 .1865 .463 .016 |
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Si3 .5472 .0834 .3176 .537 .016 |
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Al3 .5472 .0834 .3176 .463 .016 |
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Si4 .9371 .4661 .0949 .537 .016 |
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Al4 .9371 .4661 .0949 .463 .016 |
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Si5 .3506 .2200 .4069 .537 .016 |
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Al5 .3506 .2200 .4069 .463 .016 |
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O1 .502 .032 .443 .039 |
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O2 .456 .048 .158 .039 |
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O3 .418 .161 .306 .039 |
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O4 .129 .193 .451 .039 |
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O5 .304 .300 .345 .039 |
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O6 .041 .281 .070 .039 |
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O7 .416 .357 .135 .039 |
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O8 .085 .411 .215 .039 |
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O9 .807 .101 .353 .039 |
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O10 .674 .444 .045 .039 |
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Wat1 .078 .045 -.165 .039 |
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Wat2 .924 .067 .128 .039 |
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Wat3 .357 .183 -.087 .5 .039 |
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Wat4 .621 .194 .123 .5 .039 |
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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) |
| |
|
Paranatrolite |
|
Lee Y, Hriljac J A, Parise J B, Vogt T |
|
American Mineralogist 91 (2006) 247-251 |
|
Pressure-induced hydration in zeolite tetranatrolite |
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Locality: Mt. Saint-Hilaire, Quebec, Canada |
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Note: P = 1.1 GPa |
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_database_code_amcsd 0004009 |
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6.556 18.950 9.972 90 108.47 90 Cc |
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atom x y z occ Uiso |
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Na1 .158 .137 .023 .731 .048 |
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Ca1 .158 .137 .023 .237 .048 |
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Na2 .566 .079 -.075 .731 .048 |
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Ca2 .566 .079 -.075 .237 .048 |
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Si1 .500 .3757 .000 .537 .016 |
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Al1 .500 .3757 .000 .463 .016 |
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Si2 .1990 .3363 .1855 .537 .016 |
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Al2 .1990 .3363 .1855 .463 .016 |
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Si3 .5473 .0835 .3177 .537 .016 |
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Al3 .5473 .0835 .3177 .463 .016 |
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Si4 .9357 .4647 .0934 .537 .016 |
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Al4 .9357 .4647 .0934 .463 .016 |
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Si5 .3491 .2185 .4053 .537 .016 |
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Al5 .3491 .2185 .4053 .463 .016 |
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O1 .502 .033 .443 .048 |
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O2 .461 .046 .159 .048 |
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O3 .416 .161 .303 .048 |
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O4 .129 .192 .449 .048 |
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O5 .303 .299 .344 .048 |
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O6 .041 .281 .067 .048 |
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O7 .411 .357 .132 .048 |
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O8 .079 .409 .214 .048 |
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O9 .808 .100 .352 .048 |
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O10 .673 .444 .045 .048 |
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Wat1 .104 .050 -.155 .048 |
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Wat2 .929 .073 .119 .048 |
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Wat3 .356 .189 -.096 .5 .048 |
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Wat4 .598 .193 .105 .5 .048 |
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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) |
| |
|
Paranatrolite |
|
Lee Y, Hriljac J A, Parise J B, Vogt T |
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American Mineralogist 91 (2006) 247-251 |
|
Pressure-induced hydration in zeolite tetranatrolite |
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Locality: Mt. Saint-Hilaire, Quebec, Canada |
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Note: P = 2.5 GPa |
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_database_code_amcsd 0004010 |
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6.512 18.850 9.901 90 108.73 90 Cc |
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atom x y z occ Uiso |
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Na1 .156 .135 .021 .731 .030 |
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Ca1 .156 .135 .021 .237 .030 |
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Na2 .569 .082 -.071 .731 .030 |
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Ca2 .569 .082 -.071 .237 .030 |
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Si1 .500 .3803 .000 .537 .054 |
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Al1 .500 .3803 .000 .463 .054 |
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Si2 .1989 .3362 .1854 .537 .054 |
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Al2 .1989 .3362 .1854 .463 .054 |
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Si3 .5493 .0855 .3197 .537 .054 |
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Al3 .5493 .0855 .3197 .463 .054 |
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Si4 .9350 .4640 .0927 .537 .054 |
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Al4 .9350 .4640 .0927 .463 .054 |
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Si5 .3479 .2173 .4042 .537 .054 |
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Al5 .3479 .2173 .4042 .463 .054 |
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O1 .475 .035 .434 .030 |
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O2 .472 .047 .158 .030 |
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O3 .442 .166 .304 .030 |
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O4 .137 .183 .446 .030 |
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O5 .289 .299 .346 .030 |
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O6 .044 .278 .067 .030 |
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O7 .414 .355 .132 .030 |
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O8 .076 .408 .214 .030 |
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O9 .814 .093 .352 .030 |
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O10 .665 .450 .057 .030 |
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Wat1 .065 .061 -.130 .030 |
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Wat2 .937 .074 .115 .030 |
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Wat3 .353 .171 -.112 .5 .030 |
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Wat4 .761 .178 .194 .5 .030 |
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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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Paranatrolite |
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Seryotkin Y V, Bakakin V V, Belitsky I A |
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European Journal of Mineralogy 16 (2004) 545-550 |
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The crystal structure of paranatrolite |
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_database_code_amcsd 0007077 |
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18.971 19.204 6.5952 90 91.601 90 Fd |
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atom x y z occ Uiso |
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Na1 -.02490 .21593 .4035 .973 .0281 |
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Na10 .03054 .27995 .8792 .977 .0319 |
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K .1297 .3799 .3780 .229 .0334 |
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SiT1 .0000 .00342 .0000 .59 .0093 |
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AlT1 .0000 .00342 .0000 .41 .0093 |
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SiT21 -.08739 .04280 .3711 .60 .0099 |
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AlT21 -.08739 .04280 .3711 .40 .0099 |
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SiT22 .09389 -.04350 .3878 .60 .0087 |
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AlT22 .09389 -.04350 .3878 .40 .0087 |
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AlT23 .04920 .08768 .6238 .51 .0097 |
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SiT23 .04920 .08768 .6238 .49 .0097 |
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AlT24 -.03967 -.08993 .6133 .53 .0097 |
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SiT24 -.03967 -.08993 .6133 .47 .0097 |
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O1 .0236 .07177 .8627 .0192 |
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O10 -.0190 -.06543 .8547 .0189 |
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O2 .08596 .16672 .6247 .0154 |
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O20 -.07726 -.16908 .6194 .0152 |
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O3 .10458 .02504 .5421 .0177 |
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O30 -.09452 -.03133 .5027 .0207 |
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O4 -.02269 .09221 .4686 .0226 |
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O40 .03522 -.09895 .4819 .0197 |
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O5 -.07142 .02389 .1289 .0187 |
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O50 .06725 -.01674 .1582 .0191 |
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Ow6 .0573 .1969 .1332 .98 .0304 |
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H61 .098 .200 .199 .98 .032 |
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H62 .044 .157 .096 .98 .06 |
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Ow60 -.0482 .3184 .608 .359 .048 |
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H601 -.076 .281 .667 .36 .00 |
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H602 -.064 .335 .474 .36 .03 |
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Ow7 .0332 .3168 .5166 .685 .046 |
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H71 .081 .326 .499 .68 .003 |
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H72 .003 .361 .49 .68 .13 |
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Ow70 -.0616 .2033 .7764 .997 .052 |
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H701 -.086 .166 .704 .22 |
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H702 -.061 .197 .922 .032 |
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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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