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Bruggenite |
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Alici E, Schmidt T, Lutz H D |
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Zeitschrift fur Anorganische und Allgemeine Chemie 608 (1992) 135-144 |
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Zur kenntnis des calciumbromats und -iodats, kristallstruktur, rontgenographische, |
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IR- und Raman-spektroskopische und thermo-analytische untersuchungen |
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_database_code_amcsd 0015795 |
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8.5055 10.0221 7.5052 90 95.31 90 P2_1/c |
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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 .78679 .50723 .33351 .0092 .0084 .0089 .0005 .0010 .0008 |
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I1 .97317 .19012 .45710 .0074 .0081 .0049 -.0005 -.0004 .0008 |
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I2 .48508 .68598 .05272 .0077 .0092 .0068 .0013 .0009 .0012 |
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O1 .9791 .3598 .5427 .015 .011 .011 .002 .000 -.003 |
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O2 .1708 .1705 .3982 .006 .014 .017 .000 .003 -.002 |
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O3 .9901 .1014 .6695 .022 .023 .009 -.010 -.004 .009 |
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O4 .6477 .3132 .3842 .020 .013 .038 -.009 .011 -.003 |
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O5 .6623 .4373 .0200 .017 .026 .015 -.006 -.001 -.008 |
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O6 .5405 .6231 .2753 .015 .021 .006 .002 .000 .003 |
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Ow7 .6984 .5640 .6253 .021 .021 .013 -.008 .001 .002 |
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H1 .627 .504 .679 .04 |
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H2 .784 .616 .738 .04 |
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