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Sincosite |
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Kang H Y, Lee W C, Wang S L |
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Inorganic Chemistry 31 (1992) 4743-4748 |
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Hydrothermal synthesis and structural characterization of four layered |
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vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) |
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Locality: synthetic |
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_database_code_amcsd 0012705 |
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6.3484 6.350 6.597 106.81 94.09 90.02 P1 |
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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 .6502 .9010 .4983 .0157 .0136 .0220 .0147 .0070 .0061 .0092 |
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V1 .3422 .8625 .9413 .0058 .0060 .0054 .0061 .0014 .0007 .0014 |
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V2 .8504 .4292 .1218 .0059 .0061 .0059 .0058 .0014 .0006 .0012 |
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P1 .3425 .3978 .0367 .0061 .0054 .0063 .0069 .0010 -.0003 .0024 |
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P2 .8430 .8987 .0235 .0056 .0060 .0041 .0059 .0013 .0009 .0005 |
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O1 .3839 .9241 .1944 .012 .0127 .0145 .0073 .0008 .0008 .0007 |
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O2 .3508 .5342 .8775 .010 .0171 .0055 .0086 .0030 .0026 .0026 |
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O3 .0313 .8279 .8876 .010 .0061 .0129 .0103 .0015 .0020 .0009 |
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O4 .3142 .1589 .8991 .011 .0162 .0062 .0102 .0022 .0012 .0027 |
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O5 .6473 .8743 .8653 .009 .0058 .0124 .0099 .0031 .0012 .0032 |
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O6b .3090 .7744 .5608 .012 .0131 .0127 .0090 .0039 .0003 .0022 |
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H6A .2599 .8897 .5531 .050 |
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H6B .2517 .6506 .4537 .050 |
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O7 .8354 .3571 -.1299 .017 .0198 .0192 .0104 .0070 .0020 .0034 |
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O8 .8192 .7560 .1738 .0087 .0087 .0072 .0095 .0018 .0028 .0021 |
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O9 .1632 .4687 .1868 .0099 .0050 .0116 .0115 .0021 .0006 .0019 |
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O10 .5459 .4344 .1875 .010 .0065 .0147 .0106 .0018 .0011 .0053 |
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O11 .8708 .1351 .1720 .0098 .0157 .0037 .0090 .0007 -.0012 .0003 |
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O12b .8516 .5597 .5017 .014 .0136 .0154 .0121 -.0009 .0015 .0047 |
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H12A .7724 .4634 .5401 .050 |
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H12B .9718 .5109 .5369 .050 |
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O13b .5340 .2701 .5342 .016 .0210 .0161 .0101 .0015 .0019 .0012 |
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H13A .4124 .3535 .6235 .050 |
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H13B .5388 .3256 .4191 .050 |
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O14b .0079 .0624 .5403 .017 .0184 .0191 .0129 .0082 .0014 .0029 |
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H14A .0078 .1522 .4607 .050 |
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H14B .0706 -.0356 .4631 .050 |
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