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Wolsendorfite |
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Burns P C |
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American Mineralogist 84 (1999) 1661-1673 |
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A new complex sheet of uranyl polyhedra in the structure of wolsendorfite |
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_database_code_amcsd 0002332 |
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14.131 13.885 55.969 90 90 90 Cmcm |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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U1 .23236 .28097 .25 .0153 .0171 .0085 .0042 0 0 |
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U2 .24043 .48445 .07525 .0148 .0075 .0073 -.0021 .0018 -.0015 |
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U3 .23354 .5 0 .0127 .0086 .0188 0 0 .0023 |
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U4 .26009 .52736 .14137 .0160 .0078 .0059 -.0009 .0012 -.0003 |
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U5 .26058 .25302 .10659 .0121 .0076 .0107 -.0005 .0003 -.0001 |
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U6 .26867 .50400 .21281 .0145 .0155 .0124 -.0009 -.0011 .0062 |
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U7 .24934 .27115 .03319 .0148 .0081 .0068 .0017 -.0013 -.0011 |
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U8 .24787 .24360 .18258 .0208 .0080 .0093 .0024 .0008 -.0011 |
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Pb1 .5 .70072 .13777 .0251 .0219 .0476 0 0 -.0042 |
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Pb2 .5 .3534 -.00028 .0375 .0348 .0243 0 0 .0049 |
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Pb3 .5 .83007 .07678 .0268 .0253 .0469 0 0 -.0003 |
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Pb4 .5 .08653 .18238 .0505 .0237 .0274 0 0 .0024 |
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Pb5 .5 .3206 .07673 .1030 .0203 .0182 0 0 .0004 |
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Pb6 0 .4681 .25 .76 .0722 .0260 .0288 0 0 0 |
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Pb7 .5 .4363 .25 .48 .1199 .0157 .0510 0 0 0 |
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Pb8 0 .1683 .21848 .30 .1029 .0609 .0363 0 0 .0311 |
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Ba8 0 .1683 .21848 .36 .1029 .0609 .0363 0 0 .0311 |
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Pb7A .5 .476 .25 .48 .0548 |
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O1 .104 .305 .25 .0246 |
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O2 .246 .596 .1043 .0159 |
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O3 .368 .498 .0708 .0276 |
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O4 .360 .254 .25 .0234 |
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O5 .268 .410 .1130 .0238 |
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O6 .243 .347 .2132 .0215 |
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O7 .387 .548 .1385 .0258 |
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O8 .135 .508 .1459 .0320 |
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O9 .391 .248 .1029 .0492 |
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O10 .129 .257 .1091 .0478 |
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O11 .124 .244 .0360 .0554 |
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O12 .272 .202 .1430 .0510 |
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O13 .375 .296 .0317 .0441 |
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O14 .229 .436 .0362 .0296 |
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O15 .397 .486 .2128 .0530 |
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O16 .114 .469 .0794 .0284 |
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O17 .362 .5 0 .0724 |
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O18 .274 .584 .1791 .0439 |
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O19 .141 .524 .2133 .0567 |
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O20 .272 .159 .0038 .0531 |
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O21 .250 .318 .0723 .0665 |
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O22 .373 .221 .1881 .0286 |
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O23 .123 .267 .1763 .0315 |
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O24 .104 .5 0 .0729 |
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O25 .298 .662 .2221 .0248 |
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O26 .265 .459 .25 .0701 |
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OH27 .297 .393 .1662 .0211 |
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OH28 .292 .132 .0555 .0193 |
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Wat29 .5 .153 .2241 .0208 |
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Wat30 .5 .889 .1239 .0426 |
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Wat31 .5 .393 .1692 .0378 |
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Wat32 0 .127 .0923 .0301 |
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Wat33 .5 .143 .0583 .0408 |
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Wat34 .5 .495 .0343 .0306 |
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Wat35 .5 .415 .1131 .0605 |
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Wat36 .5 .210 .1468 .0328 |
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Wat37 .5 .931 .0404 .0800 |
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Wat38 0 .393 .2017 .0411 |
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Wat39 .5 .172 .0103 .0618 |
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Wat40 .5 .101 .1067 .0016 |
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