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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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CC=29554	Help
Title	The crystal structure of heneuite, Ca Mg5 (C O3) (P O4)3 (O H).
Authors	Romming, C.;Raade, G.
Reference	Neues Jahrbuch fuer Mineralogie. Monatshefte (1986) 1986, 351-359 Link XRef SCOPUS SCIRUS Google
Compound	C1 H1 Ca1 Mg5 O16 P3 - [Heneuite] Calcium pentamagnesium carbonate tris(phosphate) hydroxide [ABC3D5X16] [aP54] [i26] []
Cell	6.311(1), 10.843(1), 8.676(1), 95.01(1), 93.41(1), 101.04(1) P1- (2) V=578.72
Remarks	R=0.026000 : PDF =39-362 : MIN =Heneuite : At least one temperature factor missing in the paper. Anisotropic temperature factors refined but not given

Atom (site) Oxid.

x, y, z, B, Occupancy

Ca1	(2i)	2
P1	(2i)	5
P2	(2i)	5
P3	(2i)	5
Mg1	(2i)	2
Mg2	(2i)	2
Mg3	(2i)	2
Mg4	(2i)	2
Mg5	(2i)	2
O1	(2i)	-2
O2	(2i)	-2
O3	(2i)	-2
O4	(2i)	-2
O5	(2i)	-2
O6	(2i)	-2
O7	(2i)	-2
O8	(2i)	-2
O9	(2i)	-2
O10	(2i)	-2
O11	(2i)	-2
O12	(2i)	-2
O13	(2i)	-2
O14	(2i)	-2
O15	(2i)	-2
O16	(2i)	-2
C1	(2i)	4
H1	(2i)	1

-.12445(3)	0.93712(2)	0.68254(2)	1
0.20109(4)	0.17103(2)	0.96819(2)	1
-.21340(4)	0.39162(2)	0.84173(3)	1
0.36883(4)	0.92568(2)	0.66910(2)	1
0.31015(6)	0.89997(3)	0.03639(4)	1
-.33605(7)	0.38387(4)	0.46753(4)	1
0.08968(6)	0.66893(3)	0.81954(4)	1
-.41319(6)	0.81637(3)	0.35214(4)	1
-.32745(6)	0.54772(3)	0.13837(5)	1
0.36811(13)	0.08857(8)	0.0057(1)	1
-.00998(13)	0.08788(8)	0.89017(10)	1
0.16308(14)	0.24043(8)	0.12442(10)	1
0.29914(14)	0.26207(8)	0.85071(10)	1
0.01371(13)	0.46715(8)	0.82241(10)	1
-.34657(13)	0.48435(8)	0.91039(10)	1
-.20487(14)	0.28914(7)	0.95206(9)	1
-.32636(14)	0.33001(8)	0.68324(9)	1
0.56028(13)	0.03596(8)	0.73404(9)	1
0.23644(13)	0.86339(8)	0.79483(9)	1
0.46622(14)	0.82790(8)	0.57287(10)	1
0.21878(13)	0.99521(8)	0.57612(10)	1
-.37365(13)	0.38441(8)	0.23803(10)	1.
-.15315(15)	0.77335(8)	0.47967(11)	1
0.02208(14)	0.63662(9)	0.58241(10)	1
-.32222(17)	0.57651(10)	0.48806(17)	1
-.14906(17)	0.66203(10)	0.51487(12)	1
			1.