JERRYGIBBSITE [1]

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
-0.0020
0.3804
0.2500
0.6300
Mn
2
-0.0030
0.3725
0.1370
0.6900
Mn
3
-0.0039
0.3658
0.3619
0.6200
Mn
4
0.0157
0.0976
0.0817
0.8600
Mn
5
0.0013
0.6494
0.4087
0.8400
Mn
6
-0.0013
0.6567
0.1927
0.6400
Mn
7
0.0091
0.0910
0.3010
0.8100
Mn
8
-0.0187
0.3722
0.0202
0.9200
Mn
9
-0.0063
0.3578
0.4782
0.7600
Mn
10
0.0748
0.9681
0.1942
0.6600
Si
11
-0.0647
0.7812
0.3016
0.7300
Si
12
0.0847
0.9618
0.4171
0.9400
Si
13
-0.0795
0.7773
0.0806
0.8400
Si
14
0.7435
0.9673
0.1949
1.1400
O
15
0.2630
0.7724
0.3026
1.4500
O
16
0.2082
0.8216
0.1974
0.2900
O
17
0.7951
0.9177
0.3030
0.9500
O
18
0.2280
0.0414
0.1434
2.1300
O
19
0.7860
0.7031
0.3494
0.9500
O
20
0.2202
0.0371
0.2338
0.6300
O
21
0.7816
0.7189
0.2529
1.7500
O
22
0.2656
0.8039
0.0814
2.2800
O
23
0.7685
0.9718
0.4207
0.8900
O
24
0.7728
0.9228
0.0788
0.8300
O
25
0.2412
0.8098
0.4199
1.5500
O
26
0.7835
0.7097
0.1274
1.2900
O
27
0.2256
0.0367
0.3682
2.2600
O
28
0.7949
0.7225
0.0379
0.8400
O
29
0.2288
0.0308
0.4674
1.0300
O
30
0.7705
0.9730
0.5189
2.0300
OH
31
0.7615
0.2255
0.4704
2.7700
OH