SCHOEPITE [1], structure type - schoepite

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.2591
0.5132
0.7583
0.0100
U
2
0.0276
0.3775
0.7628
0.0100
U
3
0.2792
0.7451
0.7474
0.0100
U
4
-0.0008
0.6127
0.7497
0.0100
U
5
0.2797
0.0134
0.7406
0.0100
U
6
0.0117
0.8772
0.7631
0.0100
U
7
0.2607
0.2450
0.7520
0.0100
U
8
0.0396
0.1132
0.7500
0.0100
U
9
0.2786
0.5016
0.6402
0.0100
O
10
0.2473
0.5218
0.8791
0.0100
O
11
0.0229
0.3409
0.6490
0.0200
O
12
0.0302
0.4156
0.8724
0.0100
O
13
0.2344
0.7381
0.6367
0.0200
O
14
0.3262
0.7618
0.8593
0.0100
O
15
0.0162
0.6487
0.6383
0.0400
O
16
-0.0041
0.5815
0.8689
0.0100
O
17
0.3063
0.0221
0.6248
0.0200
O
18
0.2575
-0.0092
0.8559
0.0200
O
19
0.0124
0.9067
0.8803
0.0100
O
20
0.0057
0.8446
0.6484
0.0200
O
21
0.2249
0.2533
0.6364
0.0300
O
22
0.2980
0.2352
0.8685
0.0200
O
23
0.0431
0.0800
0.8616
0.0200
O
24
0.0345
0.1425
0.6332
0.0100
O
25
-0.1530
0.6265
0.7408
0.0100
O
26
0.1985
0.1205
0.7619
0.0100
O
27
0.3412
0.8803
0.7036
0.0100
OH
28
0.4180
0.4814
0.7885
0.0100
OH
29
0.1612
0.6457
0.7802
0.0100
OH
30
0.1578
0.8270
0.7948
0.0100
OH
31
-0.0372
0.7429
0.7985
0.0100
OH
32
0.1026
0.5020
0.7041
0.0100
OH
33
0.2083
0.3751
0.7845
0.0100
OH
34
0.1222
-0.0209
0.7053
0.0100
OH
35
0.3835
0.1501
0.7099
0.0100
OH
36
0.3881
0.3213
0.6980
0.0100
OH
37
0.0907
0.2490
0.8053
0.0100
OH
38
0.4422
-0.0010
0.7811
0.0100
OH
39
0.3221
-0.1226
0.5227
0.0000
H2O
40
0.4091
0.5197
0.4790
0.0200
H2O
41
0.1703
0.3499
0.4761
0.0200
H2O
42
0.1874
0.1324
0.4837
0.0300
H2O
43
0.4822
0.7469
0.5139
0.0400
H2O
44
0.1038
0.5038
0.5341
0.0200
H2O
45
0.2434
0.6184
0.4811
0.0300
H2O
46
0.1451
-0.0423
0.5225
0.0500
H2O
47
0.3871
0.1600
0.5295
0.0500
H2O
48
0.3595
0.3528
0.5145
0.0300
H2O
49
0.0895
0.7612
0.4862
0.0500
H2O
50
0.4307
0.0066
0.4664
0.0200
H2O