Albrechtschraufite Mereiter K Mineralogy and Petrology 107 (2013) 179-188 Description and crystal structure of albrechtschaufite, MgCa4F2[UO2(CO3)3]2*17-18H2O Locality: Joachimsthal, Bohemia _database_code_amcsd 0018906 13.569 13.419 11.622 115.82 107.61 92.84 P-1 atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Mg .41979 .42236 .02416 .01208 .0103 .0106 .0196 .0033 .0071 .0095 Ca1 .48138 .14003 -.01359 .01200 .0101 .0100 .0176 .00278 .00448 .0083 Ca2 .26561 .28073 .11208 .01607 .0140 .0172 .0242 .0048 .0092 .0142 Ca3 .14312 .49698 .00952 .01470 .0109 .0129 .0244 .00482 .0079 .0110 Ca4 .84563 -.14801 .60690 .02158 .0198 .0226 .0241 .0067 .0067 .0132 F1 .42284 .30237 .07639 .0158 .0163 .0146 .0251 .0075 .0108 .0140 F2 .28315 .42011 .04822 .0170 .0138 .0178 .0292 .0082 .0125 .0159 U1 .785960 .222723 .024224 .01188 .00929 .00999 .02019 .00339 .00647 .00949 O1 .74685 .15651 -.1575 .0227 .0235 .0224 .0239 .0046 .0090 .0122 O2 .82393 .2874 .2066 .0247 .0239 .0248 .0246 .0048 .0082 .0114 C1 .6367 .3698 .0125 .0133 .0106 .0134 .0196 .0028 .0072 .0098 O3 .73351 .39875 .0304 .0219 .0117 .0189 .0469 .0072 .0148 .0224 O4 .61109 .27159 .0015 .0201 .0133 .0142 .0410 .0051 .0120 .0181 O5 .57073 .43339 .0070 .0159 .0120 .0142 .0292 .0074 .0097 .0148 C2 .7097 .0058 -.0043 .0149 .0143 .0145 .0209 .0044 .0079 .0116 O6 .65044 .07884 -.0028 .0187 .0126 .0162 .0344 .0068 .0112 .0160 O7 .80697 .03892 .0097 .0209 .0123 .0173 .0417 .0064 .0125 .0192 O8 .67681 -.08996 -.0198 .0200 .0175 .0126 .0372 .0054 .0140 .0151 C3 .9999 .3096 .0624 .0156 .0137 .0139 .0236 .0031 .0094 .0108 O9 .97519 .21572 .0643 .0212 .0133 .0189 .0433 .0075 .0122 .0229 O10 .92175 .36065 .0483 .0198 .0123 .0183 .0388 .0077 .0122 .0195 O11 .09083 .34862 .0737 .0176 .0108 .0177 .0294 .0040 .0091 .0142 U2 .712257 .029017 .409056 .01376 .01459 .01152 .01319 .00350 .00292 .00546 O12 .61179 .0290 .4798 .0274 .0248 .0315 .0275 .0080 .0124 .0131 O13 .81365 .02859 .3390 .0236 .0228 .0221 .0219 .0027 .0095 .0062 C4 .6096 .1523 .2797 .0198 .0239 .0168 .0190 .0097 .0056 .0095 O14 .6776 .1997 .4022 .0337 .0492 .0159 .0200 .0090 -.0053 .0064 O15 .58873 .04167 .2163 .0213 .0233 .0144 .0196 .0038 .0014 .0067 O16 .56460 .20789 .2235 .0232 .0280 .0212 .0219 .0122 .0058 .0128 C5 .6672 -.2150 .2593 .0144 .0124 .0144 .0171 .0020 .0045 .0085 O17 .61595 -.15313 .2135 .0203 .0221 .0127 .0183 .0030 -.0010 .0064 O18 .73345 -.15961 .3839 .0202 .0236 .0147 .0157 .0036 -.0004 .0066 O19 .65280 -.32068 .1888 .0182 .0214 .0106 .0195 .0038 .0049 .0061 C6 .8780 .1388 .6711 .0181 .0192 .0164 .0166 .0041 .0060 .0062 O20 .84375 .03029 .6060 .0230 .0265 .0150 .0186 .0027 -.0005 .0062 O21 .82359 .19240 .6130 .0236 .0286 .0151 .0182 .0038 .0009 .0053 O22 .95725 .1897 .7792 .0251 .0190 .0223 .0203 .0029 -.0006 .0036 OW1 .4944 .5398 .2360 .0363 .0445 .0247 .0262 .0014 .0022 .0082 H1A .5122 .6073 .2745 .044 H1B .5140 .5184 .2920 .044 OW2 .16162 .16731 .1731 .0213 .0168 .0215 .0313 .0075 .0099 .0162 H2A .1608 .1028 .1238 .026 H2B .1030 .1779 .1499 .026 OW3 .3992 .2770 .3111 .0356 .0288 .0465 .0414 .0111 .0134 .0285 H3A .4558 .2679 .3058 .043 H3B .3810 .2362 .3380 .043 OW4 .16557 .1755 -.1257 .0295 .0237 .0242 .0307 .0110 .0065 .0062 H4A .1777 .1190 -.1776 .035 H4B .1049 .1763 -.1589 .035 OW5 .2896 .4597 .3224 .0840 .135 .067 .0303 .066 .013 .0135 H5A .2820 .5183 .3218 .101 H5B .3113 .4720 .4005 .101 OW6 .03802 .58768 .1502 .0204 .0188 .0171 .0247 .0040 .0079 .0095 H6A .0432 .6544 .1770 .024 H6B .0553 .5772 .2155 .024 OW7 .1406 .3647 -.2292 .0306 .0239 .0354 .0312 .0112 .0100 .0140 H7A .1997 .3635 -.2282 .037 H7B .1096 .3804 -.2875 .037 OW8 .26404 .6352 .2451 .0316 .0231 .0267 .0342 .0053 .0102 .0054 H8A .2356 .6826 .2843 .038 H8B .3192 .6665 .2527 .038 OW9 .9554 -.2792 .6310 .0824 .093 .081 .0398 .064 -.001 .0120 H9A .0086 -.2664 .6934 .099 H9B .9598 -.3278 .5627 .099 OW10 .9648 -.1445 .4849 .0565 .0283 .082 .0358 -.0007 .0143 .0072 H10A .0258 -.1165 .5311 .068 H10B .9616 -.2035 .4218 .068 OW11 .9914 -.0199 .8123 .0379 .0301 .0324 .0425 -.0032 -.0036 .0221 H11A .0456 -.0268 .8572 .046 H11B .9974 .0451 .8289 .046 OW12 .6816 -.0963 .6487 .0387 .0419 .0461 .0448 .0165 .0231 .0299 H12A .6311 -.1194 .5795 .046 H12B .6829 -.0313 .6962 .046 OW13 .7301 -.3298 .4698 .0889 .061 .042 .132 -.0128 -.010 .046 H13A .6872 -.3525 .3945 .107 H13B .7274 -.3788 .4910 .107 Wat14 .4693 .7833 .3448 .0729 .056 .047 .129 .0149 .054 .038 Wat15 .9132 .5259 .3904 .130 .252 .044 .060 .032 .031 .011 Wat16 .6569 .4376 .3695 .170 .264 .042 .119 -.030 -.023 .033 Wat17 .1280 .5998 .4224 .0976 .096 .115 .090 -.016 .018 .069 Wat18 .5118 .5130 .4582 .287 .099