Wadalite
Tsukimura K, Kanazawa Y, Aoki M, Bunno M
Acta Crystallographica C49 (1993) 205-207
Structure of wadalite Ca6Al5Si2O16Cl3
Note: the values for the anisoU's are from ICSD
_database_code_amcsd 0010280
CELL PARAMETERS: 12.0010 12.0010 12.0010 90.000 90.000 90.000
SPACE GROUP: I-43d
X-RAY WAVELENGTH: 1.541838
Cell Volume: 1728.432
Density (g/cm3): 3.057
MAX. ABS. INTENSITY / VOLUME**2: 22.15983501
RIR: 2.361
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
18.11 16.73 4.8994 2 1 1 12
20.94 1.93 4.2430 2 2 0 12
27.82 10.21 3.2074 3 2 1 24
29.78 39.66 3.0003 4 0 0 6
33.39 100.00 2.6835 4 2 0 24
35.07 6.05 2.5586 3 3 2 12
36.69 41.87 2.4497 4 2 2 12
38.24 10.66 2.3536 5 1 0 24
38.24 3.92 2.3536 4 3 1 24
41.20 15.73 2.1911 5 2 1 24
44.00 3.40 2.0582 5 3 0 24
46.66 6.05 1.9468 5 3 2 24
51.66 2.38 1.7695 6 3 1 24
52.85 11.35 1.7322 4 4 4 4
54.03 1.08 1.6972 5 4 3 24
54.03 3.94 1.6972 7 1 0 24
55.19 26.18 1.6642 6 4 0 24
56.33 3.99 1.6331 5 5 2 12
57.46 29.18 1.6037 6 4 2 24
60.77 1.21 1.5241 7 3 2 24
60.77 2.05 1.5241 6 5 1 24
61.85 7.22 1.5001 8 0 0 6
62.92 6.46 1.4772 7 4 1 24
67.09 3.03 1.3951 7 4 3 24
67.09 2.60 1.3951 7 5 0 24
69.13 2.18 1.3588 7 5 2 24
70.14 4.94 1.3418 8 4 0 24
71.14 1.17 1.3253 9 1 0 24
72.14 10.03 1.3094 8 4 2 24
73.13 1.27 1.2941 6 5 5 12
74.11 4.82 1.2793 6 6 4 12
75.09 1.21 1.2650 9 3 0 24
75.09 1.38 1.2650 7 5 4 24
78.98 2.73 1.2123 9 4 1 24
78.98 1.43 1.2123 8 5 3 24
81.85 1.77 1.1768 10 2 0 24
82.81 1.01 1.1656 9 4 3 24
84.71 1.08 1.1443 7 6 5 24
87.56 4.86 1.1143 10 4 0 24
87.56 5.51 1.1143 8 6 4 24
89.45 4.44 1.0955 10 4 2 24
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XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.