KCaAl2F9
	Hemon A, Le Bail A, Courbion G
	European Journal of Solid State and Inorganic Chemistry 30 (1993) 415-426
	Crystal structure approach of KCaAl2F9. A new hexagonaltungsten-
	bronze related structure
	_cod_database_code 1000103
	_database_code_amcsd 0012572
	12.343 7.152 22.679 90 90 90 C222_1
	atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	K1 .0094 0 0 .0190 .0332 .0168 0 0 -.0011
	K2 -.0218 .0143 .1667 .0214 .0242 .0166 -.0013 .0005 .0036
	Ca1 .2443 .2583 .0834 .0134 .0125 .0081 -.0059 .0007 .0007
	Ca2 0 .5201 .25 .0188 .0011 .0058 0 -.0002 0
	Al1 -.0080 .4991 .0799 .0074 .0044 .0071 -.0028 -.0015 -.0035
	Al2 .2398 .2428 -.0864 .0027 .0050 .0071 -.0001 -.0012 -.0001
	Al3 .2481 .7696 .2468 .0072 .0080 .0053 -.0015 -.0007 -.0003
	F1 .2092 .7848 .0106 .0320 .0184 .0071 .0089 -.0034 -.0056
	F2 -.0289 .5124 .1558 .0343 .0756 .0053 .0036 .0005 -.0061
	F3 .5132 0 0 .0322 .0403 .0066 0 0 .0008
	F4 .2713 .7326 .1669 .0269 .0101 .0056 .0101 -.0053 .0001
	F5 .2751 .3134 .1773 .0449 .0086 .0069 .0056 .0061 -.0024
	F6 .0539 .2796 .0841 .0273 .0137 .0218 .0025 -.0016 .0057
	F7 -.0675 .2725 -.0702 .0263 .0083 .0265 -.0092 -.0006 -.0065
	F8 .8902 .2464 .2574 .0102 .0158 .0256 -.0029 .0002 .0022
	F9 .8914 .7792 .2681 .0166 .0081 .0279 .0027 .0008 .0038
	F10 .1262 .6017 .0939 .0163 .0256 .0392 -.0101 -.0075 .0058
	F11 .1421 .4030 .4284 .0189 .0221 .0223 .0128 -.0028 -.0097
	F12 .1660 -.0402 .1034 .0284 .0092 .0160 .0105 .0047 .0019
	F13 .1805 .054 .4269 .0222 .0087 .0103 -.0107 .0057 -.0009
	F14 .2318 .5180 .2617 .0363 .0067 .0092 .0040 .0032 -.0001
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