ALUMINITE [1]

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.7008
0.3738
0.9302
1.2800
S
2
0.6558
0.4533
0.4763
0.9600
Al
3
0.0731
0.4660
0.6287
0.9700
Al
4
0.7166
0.2878
0.8897
2.7300
O
5
0.5012
0.3905
0.9217
2.4800
O
6
0.7539
0.4342
0.8525
2.1300
O
7
0.8284
0.3836
0.0584
2.1100
O
8
0.8713
0.5403
0.5230
0.9800
O
9
0.7393
0.4539
0.3423
1.2100
O
10
0.8684
0.3947
0.5778
1.1900
O
11
0.4451
0.5226
0.4023
1.2200
O
12
0.5257
0.3487
0.4235
1.8700
O
13
0.2421
0.3758
0.7019
1.7800
O
14
0.0346
0.4930
0.7774
1.8400
O
15
0.8517
0.2530
0.7101
2.4800
O
16
0.1782
0.2181
0.6079
2.7300
O
17
0.1737
0.3019
0.4012
2.3100
O
18
0.4317
0.4095
0.1035
2.1900
O
19
0.8520
0.5880
0.5540
0.0000
H
20
0.6580
0.4400
0.2830
0.0000
H
21
0.8570
0.3500
0.6080
0.0000
H
22
0.4080
0.5410
0.3420
0.0000
H
23
0.4000
0.3440
0.4100
0.0000
H
24
0.5810
0.2980
0.4090
0.0000
H
25
0.1970
0.3190
0.6800
0.0000
H
26
0.3270
0.3780
0.7800
0.0000
H
27
0.9360
0.4720
0.8020
0.0000
H
28
0.1000
0.5330
0.8310
0.0000
H
29
0.7940
0.2630
0.7750
0.0000
H
30
0.7800
0.2180
0.6610
0.0000
H
31
0.5060
0.1850
0.5940
0.0000
H
32
0.2680
0.1810
0.6210
0.0000
H
33
0.0710
0.2790
0.3310
0.0000
H
34
0.1560
0.2750
0.4670
0.0000
H
35
0.4580
0.4050
0.0610
0.0000
H
36
0.3700
0.4660
0.1300
0.0000
H