Amarantite
	Mereiter K
	ICSD Communications 2018 (2018) https://dx.doi.org/10.25505/fiz.icsd.cc20vqvg
	Experimental crystal structure determination
	Note: T = 100 K
	Locality: Tierra Amarilla, Chile
	_database_code_amcsd 0020885
	6.6278 8.8605 11.5790 97.564 95.709 90.355 P-1
	atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Fe1 .35586 .58823 .56394 .00506 .00500 .00535 .00484 .00026 .00061 .00065
	Fe2 .72601 .42698 .73715 .00544 .00533 .00609 .00503 .00035 .00050 .00124
	S1 .42256 .67187 .85013 .00601 .00599 .00695 .00498 .00024 .00062 .00034
	O1 .35448 .70163 .72753 .00756 .0097 .0083 .0046 .00104 .00024 .00072
	O2 .53395 .52634 .84282 .00873 .0100 .0086 .0082 .00309 .00282 .00199
	O3 .24095 .65498 .90930 .01041 .0075 .0166 .0079 .0016 .00294 .0028
	O4 .55386 .79765 .90699 .01126 .0134 .0096 .0094 -.0032 -.0023 -.0008
	S2 -.05575 .71187 .43207 .00529 .00498 .00522 .00590 .00031 .00082 .00141
	O5 .06463 .66801 .53826 .00743 .0064 .0098 .0063 .00131 .00002 .00250
	O6 .08264 .72074 .34002 .00749 .0073 .0083 .0076 .00069 .00296 .00199
	O7 -.15008 .85710 .45951 .00896 .0100 .0067 .0108 .00298 .00309 .0017
	O8 -.21049 .59144 .38790 .00823 .0075 .0078 .0094 -.00256 -.00094 .00271
	O9 .61304 .48829 .59596 .00655 .0065 .0079 .0053 .00097 .00029 .00117
	O1W .47052 .79781 .53909 .00935 .0109 .0084 .0092 -.00154 .00311 .0012
	H1A .53892 .83803 .59574 .028
	H1B .53006 .80414 .48307 .028
	O2W .90906 .61746 .75213 .00877 .0083 .0105 .0075 -.00222 -.00007 .0019
	H2A .93580 .64089 .69092 .042
	H2B .00973 .62781 .79687 .028
	O3W .89662 .38697 .88658 .01055 .0092 .0163 .0070 .0039 .00153 .0042
	H3A .84708 .37561 .94516 .034
	H3B .99775 .33824 .88482 .025
	O4W .54804 .23774 .73279 .01009 .0087 .0079 .0147 .00024 .0037 .0031
	H4A .59428 .15464 .73345 .031
	H4B .45368 .24344 .77109 .027
	O5W .68862 .95517 .73111 .01241 .0111 .0103 .0163 -.0007 .0010 .0037
	H5A .80904 .95389 .72969 .030
	H5B .66150 .91509 .78577 .040
	O6W .10335 .96652 .72094 .01150 .0141 .0089 .0118 .0018 .0017 .0024
	H6A .17000 .89141 .71842 .025
	H6B .11004 .00191 .66131 .037
	O7W .23899 .21972 .87282 .01131 .0116 .0117 .0102 -.0002 -.0009 .0010
	H7B .29138 .20604 .93577 .040
	H7A .20096 .13892 .83804 .028
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