Godlevskite
	Fleet M E
	Acta Crystallographica C43 (1987) 2255-2257
	Structure of godlevskite, Ni9S8
	9.3359 11.2185 9.4300 90 90 90 C222
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	Nil .22010 0 0 .967 .52 .00172 .00078 .00155 0 0 .00022
	Fel .22010 0 0 .033 .52 .00172 .00078 .00155 0 0 .00022
	Ni2 0 .5 0 .967 .44 .00155 .00095 .00111 0 0 0
	Fe2 0 .5 0 .033 .44 .00155 .00095 .00111 0 0 0
	Ni3 0 0 .21521 .967 .54 .00162 .00094 .00162 .00028 0 0
	Fe3 0 0 .21521 .033 .54 .00162 .00094 .00162 .00028 0 0
	Ni4 .25 .25 .27187 .967 .51 .00146 .00089 .00161 -.00003 0 0
	Fe4 .25 .25 .27187 .033 .51 .00146 .00089 .00161 -.00003 0 0
	Ni5 0 .23652 .5 .967 .76 .00314 .00067 .00235 0 -.00111 0
	Fe5 0 .23652 .5 .033 .76 .00314 .00067 .00235 0 -.00111 0
	Ni6 0 0 .5 .967 .74 .00217 .00167 .00174 0 0 0
	Ni6 0 0 .5 .033 .74 .00217 .00167 .00174 0 0 0
	Ni7 .37369 .68414 .12145 .967 .48 .00142 .00095 .00133 .00008 -.00001 -.00005
	Fe7 .37369 .68414 .12145 .033 .48 .00142 .00095 .00133 .00008 -.00001 -.00005
	Ni8 .12569 .58779 .37368 .967 .51 .00131 .00128 .00120 .00009 .00006 -.00017
	Fe8 .12569 .58779 .37368 .033 .51 .00131 .00128 .00120 .00009 .00006 -.00017
	S1 .13268 .61610 .13483 .51 .00142 .00112 .00129 -.00001 .00004 -.00005
	S2 .36724 .61693 .36158 .53 .00145 .00139 .00110 .00007 -.00027 -.00021
	S3 .38213 .34835 .11982 .56 .00139 .00129 .00147 -.00031 -.00019 .00002
	S4 .11977 .38020 .38590 .60 .00181 .00134 .00141 .00023 .00011 -.00016
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	Godlevskite
	Merlino S, Makovicky E
	European Journal of Mineralogy 21 (2009) 863-869
	OD (order-disorder) character of the crystal structure of godlevskite Ni9S8
	Locality: modelled structure, not experimental
	9.38 9.38 22.44 90 90 90 I-42d
	atom x y z occ
	Ni1 0 -.217 0
	Ni2 0 .5 0
	Ni4 .25 -.2719 .125 .5
	Ni5 .5 .5 .1318
	Ni7 .1263 .1215 .0921
	Ni8 .3743 -.3737 -.0439
	S1 .1338 -.3645 -.0648
	S1A -.1338 -.3645 .0648
	S3 .1179 -.1198 .0648
	S4 .3802 -.3859 .0648
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure

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