AENIGMATITE [2], structure type - aenigmatite

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.0000
0.0000
0.5000
0.8900
Fe=0.8900, Ti=0.1100
2
0.0000
0.5000
0.0000
0.8500
Fe=0.8700, Ti=0.1300
3
0.3214
0.8528
0.1779
0.9200
Fe=0.9500, Ti=0.0500
4
0.7655
0.8199
0.1511
0.9300
Fe=0.7600, Ti=0.2400
5
0.0961
0.9392
0.0530
1.0100
Fe=0.9000, Ti=0.1000
6
0.5959
0.9432
0.0661
0.9200
Fe
7
0.9970
0.7434
0.2577
0.7000
Ti=0.5900, Fe=0.4100
8
0.2089
0.6298
0.3893
0.5500
Na
9
0.6607
0.6117
0.3741
1.0600
Na
10
0.4768
0.2345
0.3313
0.4100
Si
11
0.9864
0.2363
0.3466
0.3900
Si
12
0.7921
0.3435
0.2416
0.4000
Si=0.9000, Fe=0.1000
13
0.2772
0.3382
0.2252
0.6200
Si=0.9500, Fe=0.0500
14
0.6487
0.9448
0.4447
0.5000
Si=0.9400, Fe=0.0600
15
0.3528
0.5588
0.0501
0.5100
Si=0.9500, Fe=0.0500
16
0.3542
0.0641
0.1621
0.6400
O
17
0.8611
0.0666
0.1807
0.4300
O
18
0.5440
0.9534
0.2958
0.7500
O
19
0.0151
0.9258
0.2670
0.8300
O
20
0.2353
0.8747
0.3933
0.6500
O
21
0.7541
0.8843
0.3902
0.6300
O
22
0.4929
0.1948
0.4973
0.7500
O
23
0.9675
0.7755
0.4871
0.5800
O
24
0.8996
0.3230
0.3735
0.7600
O
25
0.4034
0.3364
0.3529
0.9300
O
26
0.6653
0.1744
0.0709
0.5700
O
27
0.1570
0.1688
0.0612
0.5700
O
28
0.5233
0.7108
0.0393
0.5600
O
29
0.0673
0.7340
0.0757
0.3700
O
30
0.2417
0.6060
0.1120
0.8900
O
31
0.7510
0.6018
0.1275
0.6400
O
32
0.4002
0.5015
0.1883
0.5200
O
33
0.9363
0.5147
0.2264
1.0900
O
34
0.1648
0.3649
0.3183
0.6200
O
35
0.6731
0.3626
0.3466
0.9900
O