Chiavennite
	Tazzoli V, Domeneghetti M C, Mazzi F, Cannillo E
	European Journal of Mineralogy 7 (1995) 1339-1334
	The crystal structure of chiavennite
	_database_code_amcsd 0006609
	8.729 31.326 4.903 90 90 90 Pnab
	atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Ca .2500 .0879 0 .0183 .0275 .0138 .0138 0 .0004 0
	Mn 0 0 0 .0152 .0234 .0122 .0099 -.0018 0 .0005
	Be -.0003 .0572 -.4298 .0090 .0166 .0075 .0029 -.0010 .0056 -.0030
	Si1 .2500 .0013 .5000 .0124 .0170 .0100 .0101 0 -.0014 0
	Si2 .5838 .2322 .1047 .0185 .0222 .0113 .0218 .0022 .0023 .0009
	Si3 .1425 -.1351 .2436 .0194 .0213 .0120 .0250 -.0005 -.0028 .0013
	O1 .1392 -.0279 .3134 .0155 .0169 .0124 .0171 -.0011 -.0019 -.0039
	O2 .1517 .0324 -.2957 .0153 .0196 .0123 .0139 .0011 -.0007 -.0015
	O3 .0414 .2391 .1347 .0409 .0357 .0431 .0437 .0011 -.0136 -.0149
	O4 .2500 -.2478 0 .0285 .0294 .0190 .0371 0 .0088 0
	O5 .2500 -.1187 0 .0773 .0768 .0314 .1236 0 .0821 0
	O6 .2500 -.1387 .5000 .1049 .1139 .0510 .1497 0 -.1032 0
	O7 .0800 -.1824 .1773 .0342 .0350 .0141 .0534 -.0026 .0091 -.0109
	O8 .0005 -.1044 .2905 .0207 .0250 .0132 .0239 -.0033 .0043 -.0058
	OH .0125 .0581 .2430 .0207 .0266 .0162 .0192 .0017 -.0029 -.0001
	Wat .1581 .1474 .2602 .0371 .0431 .0322 .0359 .0098 -.0032 -.0139
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