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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=75269
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Title
Synthesis and structures of two isostructural phosphites, Fe11 (H PO3)8 (O H)6 and Mn11 (H P O3)8 (O H)6.
Authors
Attfield, M.P.;Morris, R.E.;Cheetham, A.K.
Reference
IC&volume=50&fpage=981&details=yes target=icsd_help>Acta Crystallographica C (1994)
50
, 981-984
Link
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Compound
H14 Mn11 O30 P8
- Undecamanganese octakis(hydrogenphosphate(III)) hexahydroxide
[
A8B11X30
] [
hP63
] [
d2 c4 b
] [
]
Cell
13.1957(6), 13.1957(6), 5.1770(3), 90., 90., 120.
P63MC (186)
V=780.68
Remarks
R=0.077000 : D X
The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct.
Difference between the formula calculated from the PARM record and the FORM record tolerable.
Atom (site) Oxid.
x, y, z, B, Occupancy
Mn1
(12d)
2
P1
(6c)
3
P2
(2b)
3
O1
(6c)
-2
O2
(12d)
-2
O3
(6c)
-2
O4
(6c)
-2
H1
(6c)
1
H2
(2b)
1
H3
(12d)
1
0.57
0.65
0.07
0.00
0.91
0.83
0.16
0.05
0.00
1
0.33
0.66
0.82
0.00
1
0.80
0.19
0.80
0.01
1
0.65
0.92
0.71
0.01
1
0.60
0.39
0.42
0.01
1
0.52
0.47
0.89
0.01
1
0.89
0.10
0.97
0.02
1
0.33
0.66
0.57
0.02
1
0
0.5
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