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Attakolite |
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Grice J D, Dunn P J |
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American Mineralogist 77 (1992) 1285-1291 |
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Attakolite: New data and crystal-structure determination |
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_database_code_amcsd 0001542 |
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17.188 11.477 7.322 90 113.83 90 C2/m |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca 0 .2592 0 .0109 .0146 .0101 0 .0063 0 |
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Mn .2870 0 .0488 .0054 .0116 .0125 0 .0013 0 |
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Al1 .1329 .3670 .4964 .0071 .0058 .0071 -.0009 .0027 .0006 |
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Al2 .1190 .1292 .7685 .0068 .0060 .0064 -.0006 .0024 .0000 |
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Si .0515 0 .3308 .0062 .0061 .0057 0 .0020 0 |
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P1 .4664 0 .2349 .0061 .0071 .0070 0 .0030 0 |
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P2 .2094 .2534 .1948 .0056 .0057 .0060 -.0001 .0025 -.0003 |
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O1 .4068 0 .3532 .008 .012 .011 0 .0056 0 |
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O2 .4045 0 .0169 .010 .018 .008 0 .0027 0 |
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O3 -.0057 -.1135 .2474 .0081 .0082 .0091 -.0002 .0030 -.0003 |
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O4 .2691 .1472 .2618 .0070 .0072 .0073 .0013 .0020 -.0005 |
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O5 .2621 .3610 .1893 .0083 .0076 .0112 -.0006 .0041 .0009 |
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O6 .1629 .2742 .3297 .0118 .0104 .0119 -.0006 .0084 -.0016 |
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O7 .0948 0 -.4268 .011 .007 .009 0 .004 0 |
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O8 .5228 -.1091 .2854 .0079 .0076 .0113 .0010 .0034 -.0001 |
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O9 .1395 .2315 -.0145 .0078 .0096 .0074 .0006 .0018 -.0012 |
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O11 .1258 0 .2566 .015 .020 .012 0 .009 0 |
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O12 .1770 .5 .4372 .012 .009 .009 0 .007 0 |
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O13 .0884 .2440 .5809 .0051 .0109 .0070 -.0019 .0004 .0015 |
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O14 .1546 0 -.0609 .010 .007 .006 .008 .004 0 |
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H1 .339 .5 -.321 0.03 |
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H2 .682 0 .357 0.03 |
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H3 .555 -.226 .510 0.03 |
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H4 .152 0 .021 0.03 |
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