PDF-46

46-0214
In-F-H-O
Monoklin
Grupa 4,11

Dexp Dcal d(D) h k l

5.6100 5.5591 .0509 2 0 0
5.1160 5.1129 .0031 -1 1 1
4.5480 4.5493 -.0013 1 1 1
3.7080 3.7061 .0019 3 0 0
3.6330 3.6318 .0012 -3 0 3
2.9550 2.9531 .0019 -4 0 1
2.5060 2.5058 .0002 4 1 0
2.4600 2.4606 -.0006 -2 0 6
2.2780 2.2776 .0004 -4 1 5
1.9970 1.9968 .0002 -3 2 5
1.9840 1.9838 .0002 -4 2 4
1.8940 1.8940 .0000 -6 1 3
1.8480 1.8481 -.0001 0 1 7


a= 12.0300 b= 5.790 c= 14.7700 beta= 112.445
da= .0007 db= .001 dc=.0001 dbet= .001
V= 950.8


Triklin

Dexp Dcal d(D) h k l
5.6100 5.6086 .0014 0 1 1
5.1160 5.1132 .0028 0 -1 1
4.5480 4.5459 .0021 -1 0 1
3.7080 3.7075 .0005 -1 3 0
3.6330 3.6326 .0004 1 1 1
2.9550 2.9551 -.0001 0 1 2
2.5060 2.5062 -.0002 0 5 0
2.4600 2.4599 .0001 -1 5 0
2.2780 2.2781 -.0001 1 -2 2
1.9970 1.9971 -.0001 -2 -2 2
1.9840 1.9840 .0000 -3 1 1
1.8940 1.8939 .0001 -1 -1 3
1.8480 1.8480 .0000 2 4 1

A= 6.020 DA= .001
B= 12.86960 DB= .00004
C= 6.06433 DC= .00002
GAMMA=101.28 DGAMMA= .02
BETA =101.12 DBETA = .01
ALPHA= 81.22 DALPHA= .01
V= 448.9

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