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Hydrodresserite |
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Szymanski J T |
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The Canadian Mineralogist 20 (1982) 253-262 |
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The crystal structure of hydrodresserite BaAl2(CO3)2(OH)4.3H2O |
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9.7545 10.4069 5.6322 95.695 92.273 115.643 P-1 |
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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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Ba .14318 .18123 .21261 .0146 .0154 .0108 .0064 .0002 -.0010 |
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Al1 0 .5 .5 .0108 .0123 .0040 .0068 .0014 .0018 |
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Al2 0 .5 0 .0105 .0110 .0044 .0061 .0011 .0012 |
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Al3 .5 .5 0 .0099 .0109 .0049 .0049 .0011 .0024 |
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Al4 .5 .5 .5 .0101 .0107 .0041 .0046 .0005 .0011 |
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C1 .0471 .2772 .7143 .0116 .0121 .0105 .0070 .0015 .0022 |
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O1 .0403 .3368 .9245 .0172 .0141 .0066 .0092 .0018 .0015 |
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O2 .0376 .3351 .5231 .0192 .0153 .0067 .0111 .0018 .0019 |
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O3 .0660 .1642 .6941 .0292 .0181 .0136 .0176 .0048 .0032 |
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C2 .3953 .2263 .6884 .0147 .0112 .0097 .0056 .0028 .0016 |
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O4 .4185 .2917 .9048 .0205 .0127 .0078 .0068 .0010 .0022 |
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O5 .4187 .2969 .5055 .0191 .0136 .0072 .0074 .0015 .0032 |
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O6 .3513 .0926 .6517 .0521 .0095 .0204 .0097 .0139 .0027 |
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O7 .1329 .5925 .7756 .0107 .0122 .0063 .0029 .0015 .0021 |
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O8 .3833 .5120 .7457 .0107 .0194 .0076 .0105 .0014 .0025 |
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O9 .1446 .5636 .2713 .0105 .0116 .0077 .0054 .0002 .0008 |
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O10 .6400 .5367 .7661 .0086 .0149 .0067 .0069 .0006 .0021 |
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O11 .1643 .9554 .9492 .0223 .0210 .0281 .0088 .0083 .0111 |
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O12 .5764 .1591 .1717 .0442 .0400 .0404 .0246 .0036 .0077 |
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O13 .3152 .8664 .3114 .0311 .0243 .0398 .0089 .0093 -.0016 |
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H1 .174 .654 .784 .0097 |
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H2 .327 .528 .749 .0126 |
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H3 .179 .621 .288 .0099 |
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H4 .678 .507 .773 .0101 |
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H5 .220 .993 .869 .0238 |
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H6 .202 .920 .029 .0238 |
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H7 .521 .188 .119 .0415 |
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H8 .581 .167 .319 .0415 |
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H9 .329 .928 .419 .0317 |
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H10 .404 .893 .261 .0317 |
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