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Peretaite |
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Menchetti S, Sabelli C |
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American Mineralogist 65 (1980) 940-946 |
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Peretaite, CaSb4O4(OH)2(SO4)2*2H2O: Its atomic arrangement and twinning |
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_database_code_amcsd 0000796 |
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24.665 5.6006 10.185 90 95.98 90 C2/c |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Sb1 .29249 .50504 .51525 0.0002 0.0072 0.0023 0.0001 0.0002 0.0016 |
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Sb2 .31537 .05196 .26706 0.0003 0.0048 0.0018 0.0002 0.0002 -.0001 |
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Ca .5 .1856 .25 0.0003 0.0083 0.0022 0 0.0001 0 |
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S .4201 -.0163 .5184 0.0003 0.0083 0.0023 -.0001 0.0001 0.0004 |
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O1 .3600 .0049 .5276 0.0003 0.0253 0.0049 0.0003 0.0003 0.0001 |
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O2 .4296 .0463 .3829 0.0006 0.0142 0.0036 0.0001 0.0004 0.0028 |
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O3 .4511 .1391 .6159 0.0008 0.0121 0.0040 0.0003 -.0003 -.0023 |
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O4 .4378 -.2635 .5487 0.0010 0.0065 0.0033 0.0001 -.0001 0.0007 |
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O5 .4446 .5206 .3043 0.0005 0.0090 0.0039 -.0004 0.0003 -.0005 |
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O6 .2609 .1778 .3871 0.0001 0.0068 0.0018 -.0002 0.0004 -.0001 |
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O7 .2625 .1787 .1146 0.0002 0.0052 0.0011 -.0003 -.0001 0.0003 |
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O8 .3394 .3860 .2667 0.0003 0.0066 0.0041 -.0003 0.0002 0.0001 |
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H1 .450 .600 .210 4. |
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H2 .450 .660 .380 4. |
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H3 .382 .420 .285 4. |
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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