Institute of Experimental Mineralogy
Russian Academy of Sciences
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142432, Chernogolovka, Moscow district
A.V. Chichagov +7(496)52-22320
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*** W W W - X R A Y P O L ***
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DICKITE
2, f-kaolinite-halloysite, sf-kaolinite, DF
Al(2)[Si(2)O(7)](OH)(4)
Monoclinic C c Z = 4
R =0.03
22 .3 .1995
Ref.Str.:
Okada K., Ossaka J. (1982)
* J. Amer. Ceram. Soc., 65, 21-24
Reserv:
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.15 alpha = 90.0
b = 8.94 beta = 96.73
c = 14.424 gamma = 90.0
Unit cell volume (cub. angs.) = 659.52
Molar volume ( cub.cm/mol.) = 99.31
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0117 0.5999 0.5405 0.0 Si = 1.00
2 0.983 0.926 0.538 0.0 Si = 1.00
3 0.958 0.7621 0.7333 0.0 Al = 1.00
4 0.88 0.0733 0.7254 0.0 Al = 1.00
5 0.926 0.769 0.499 0.0 O = 1.00
6 0.286 0.503 0.538 0.0 O = 0.5 , O = 0.0
7 0.746 0.029 0.498 0.0 O = 0.5 , O = 0.0
8 0.779 0.48 0.509 0.0 O = 0.5 , O = 0.0
9 0.268 0.985 0.505 0.0 O = 0.5 , O = 0.0
10 0.945 0.628 0.652 0.0 O = 0.5 , O = 0.0
11 0.701 0.169 0.642 0.0 O = 0.5 , O = 0.0
12 0.974 0.913 0.66 0.0 O = 1.00
13 0.21 0.715 0.797 0.0 O = 0.5 , O = 0.0
14 0.015 0.204 0.806 0.0 O = 0.5 , O = 0.0
15 0.82 0.91 0.785 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0117 0.5999 0.5405
2 2 0.983 0.926 0.538
3 3 0.958 0.7621 0.7333
4 4 0.88 0.0733 0.7254
5 5 0.926 0.769 0.499
6 6 0.286 0.503 0.538
7 7 0.746 0.029 0.498
8 8 0.779 0.48 0.509
9 9 0.268 0.985 0.505
10 10 0.945 0.628 0.652
11 11 0.701 0.169 0.642
12 12 0.974 0.913 0.66
13 13 0.21 0.715 0.797
14 14 0.015 0.204 0.806
15 15 0.82 0.91 0.785
16 1 0.0117 0.4001 0.0405
17 2 0.983 0.074 0.038
18 3 0.958 0.2379 0.2333
19 4 0.88 0.9267 0.2254
20 5 0.926 0.231 0.999
21 6 0.286 0.497 0.038
22 7 0.746 0.971 0.998
23 8 0.779 0.52 0.009
24 9 0.268 0.015 0.005
25 10 0.945 0.372 0.152
26 11 0.701 0.831 0.142
27 12 0.974 0.087 0.16
28 13 0.21 0.285 0.297
29 14 0.015 0.796 0.306
30 15 0.82 0.09 0.285
31 1 0.5117 0.9001 0.0405
32 2 0.483 0.574 0.038
33 3 0.458 0.7379 0.2333
34 4 0.38 0.4267 0.2254
35 5 0.426 0.731 0.999
36 6 0.786 0.997 0.038
37 7 0.246 0.471 0.998
38 8 0.279 0.02 0.009
39 9 0.768 0.515 0.005
40 10 0.445 0.872 0.152
41 11 0.201 0.331 0.142
42 12 0.474 0.587 0.16
43 13 0.71 0.785 0.297
44 14 0.515 0.296 0.306
45 15 0.32 0.59 0.285
46 1 0.5117 0.0999 0.5405
47 2 0.483 0.426 0.538
48 3 0.458 0.2621 0.7333
49 4 0.38 0.5733 0.7254
50 5 0.426 0.269 0.499
51 6 0.786 0.003 0.538
52 7 0.246 0.529 0.498
53 8 0.279 0.98 0.509
54 9 0.768 0.485 0.505
55 10 0.445 0.128 0.652
56 11 0.201 0.669 0.642
57 12 0.474 0.413 0.66
58 13 0.71 0.215 0.797
59 14 0.515 0.704 0.806
60 15 0.32 0.41 0.785
X-ray density (g/cm cub.) = 2.24
MU (1/cm) = 73.642 Mass attenuation coefficient (cm**2/g) = 32.929
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Si 2.1 7
1.6663 5
1.6611 6
1.6322 8
1.7021 10
1.5514 7
1.6559 9
1.7723 11
2 Si 2.1 6
1.5277 5
1.5829 7
1.6801 9
1.7696 12
1.226 6
1.6974 8
3 Al 2.316 5
1.6729 10
1.7219 12
1.5577 13
1.7128 15
2.0927 11
4 Al 2.316 5
1.664 11
1.8125 12
1.7352 14
1.7401 15
1.9104 13
5 O 3.264 13
3.0273 6
2.5018 7
2.7009 8
2.6082 9
2.5334 10
2.6414 12
2.8839 14
2.9979 13
2.3038 6
2.7065 7
2.612 8
2.6707 9
2.5248 11
6 O ,O 3.264 10
3.0273 5
2.6292 8
2.6036 8
2.7773 10
2.3038 5
0.6336 7
2.5867 9
2.6592 9
2.1905 11
2.0693 12
7 O ,O 3.264 11
2.5018 5
2.7071 9
2.5066 9
2.4591 11
2.6965 12
3.1869 15
2.7065 5
0.6336 6
2.7658 8
2.4679 8
2.9879 10
8 O ,O 3.264 10
2.7009 5
2.6036 6
2.6292 6
2.5145 10
2.612 5
2.4679 7
2.7658 7
0.0881 9
3.2064 11
2.8934 12
9 O ,O 3.264 10
2.6082 5
2.5066 7
2.7071 7
3.2482 11
2.9152 12
2.6707 5
2.6592 6
2.5867 6
0.0881 8
2.5511 10
10 O ,O 3.264 10
2.5334 5
2.7773 6
2.5145 8
2.5541 12
2.4845 13
2.9879 7
2.5511 9
1.3921 11
3.1076 12
3.2156 15
11 O ,O 3.264 11
2.4591 7
3.2482 9
2.6826 12
2.7225 14
3.1137 15
2.5248 5
2.1905 6
3.2064 8
1.3921 10
2.5027 12
2.2684 13
12 O 3.264 11
2.6414 5
2.6965 7
2.9152 9
2.5541 10
2.6826 11
2.82 13
2.0532 15
2.0693 6
2.8934 8
3.1076 10
2.5027 11
13 O ,O 3.264 7
2.4845 10
2.82 12
2.6498 15
2.9979 5
2.2684 11
1.564 14
2.7944 15
14 O ,O 3.264 5
2.7225 11
2.8173 15
2.8839 5
1.564 13
2.4621 15
15 O 3.264 8
3.1137 11
2.0532 12
2.6498 13
2.8173 14
3.1869 7
3.2156 10
2.7944 13
2.4621 14
X-ray diffraction powder data (II), X-Ray W.L. = 1.54056(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 0 0 2 6.174 12.348 0.07 169.95 2 110.8 959.9
2 0 2 0 9.923 19.846 0.112 64.43 2 46.7 64.7
3 1 1 0 9.992 19.984 0.113 63.52 4 93.9 514.7
4 1 1 -1 10.157 20.315 0.114 61.4 4 115.8 756.8
5 0 2 1 10.4 20.8 0.117 58.47 4 19.5 20.5
6 1 1 1 10.766 21.533 0.121 54.41 4 103.8 538.8
7 1 1 -2 11.222 22.445 0.126 49.91 4 60.6 168.5
8 0 2 2 11.72 23.44 0.132 45.59 4 92.5 358.6
9 1 1 2 12.312 24.624 0.138 41.11 4 64.1 155.5
10 0 0 4 12.421 24.842 0.14 40.36 2 190.8 675.4
11 1 1 -3 12.978 25.956 0.146 36.8 4 34.8 40.9
12 0 2 3 13.653 27.307 0.153 33.05 4 19.2 11.2
13 1 1 3 14.397 28.795 0.161 29.52 4 14.2 5.5
14 1 1 -4 15.204 30.408 0.17 26.27 4 24.2 14.1
15 0 2 4 15.998 31.997 0.179 23.55 4 37.2 30.0
16 1 1 4 16.844 33.688 0.188 21.06 4 54.5 57.4
17 1 3 0 17.407 34.814 0.194 19.6 4 21.1 8.0
18 1 3 -1 17.507 35.013 0.195 19.36 4 69.1 85.0
19 2 0 0 17.53 35.061 0.196 19.3 2 140.9 176.2
20 1 1 -5 17.746 35.492 0.198 18.79 4 64.6 72.2
21 1 3 1 17.882 35.764 0.199 18.48 4 62.6 66.6
22 2 0 -2 17.923 35.846 0.2 18.39 2 27.9 6.6
23 1 3 -2 18.172 36.344 0.202 17.84 4 29.4 14.2
24 0 2 5 18.624 37.247 0.207 16.9 4 15.2 3.6
25 0 0 6 18.823 37.645 0.209 16.51 2 96.6 70.8
26 1 3 2 18.894 37.788 0.21 16.38 4 27.5 11.4
27 1 3 -3 19.354 38.707 0.215 15.53 4 110.0 172.9
28 2 0 2 19.359 38.719 0.215 15.52 2 100.7 72.3
29 1 1 5 19.542 39.083 0.217 15.2 4 66.3 61.4
30 0 4 0 20.16 40.32 0.224 14.18 2 9.5 0.6
31 2 2 -1 20.226 40.451 0.224 14.08 4 17.2 3.8
32 2 2 0 20.305 40.611 0.225 13.96 4 43.9 24.8
33 1 3 3 20.375 40.749 0.226 13.85 4 108.8 150.8
34 0 4 1 20.415 40.83 0.226 13.79 4 14.1 2.5
35 2 0 -4 20.427 40.854 0.227 13.77 2 101.3 65.0
36 1 1 -6 20.515 41.029 0.227 13.64 4 11.7 1.7
37 2 2 -2 20.653 41.305 0.229 13.44 4 3.0 0.1
38 2 2 1 20.887 41.774 0.231 13.1 4 12.4 1.8
39 1 3 -4 20.978 41.956 0.232 12.98 4 9.2 1.0
40 0 4 2 21.164 42.327 0.234 12.72 4 35.6 14.8
41 0 2 6 21.455 42.91 0.237 12.34 4 61.3 42.6
42 2 2 -3 21.562 43.124 0.239 12.2 4 57.7 37.4
43 2 2 2 21.938 43.877 0.243 11.74 4 41.8 18.9
44 1 3 4 22.248 44.497 0.246 11.37 4 13.7 1.9
45 0 4 3 22.367 44.733 0.247 11.24 4 39.5 16.1
46 1 1 6 22.431 44.861 0.248 11.16 4 35.1 12.6
47 2 2 -4 22.907 45.814 0.253 10.65 4 71.5 50.1
48 2 0 4 22.961 45.922 0.253 10.59 2 59.8 17.4
49 1 3 -5 22.97 45.94 0.253 10.58 4 62.6 38.1
50 2 2 3 23.409 46.817 0.258 10.14 4 28.2 7.4
51 1 1 -7 23.461 46.922 0.258 10.09 4 31.0 8.9
52 0 4 4 23.97 47.94 0.264 9.61 4 61.6 33.5
53 1 3 5 24.447 48.894 0.269 9.19 4 77.4 50.6
54 0 2 7 24.455 48.91 0.269 9.18 4 35.7 10.8
55 2 0 -6 24.506 49.012 0.269 9.14 2 87.5 32.2
56 2 2 -5 24.633 49.267 0.271 9.03 4 49.4 20.3
57 2 2 4 25.244 50.487 0.277 8.54 4 52.2 21.4
58 1 3 -6 25.268 50.536 0.277 8.52 4 19.1 2.9
59 0 0 8 25.479 50.959 0.279 8.36 2 86.0 28.4
60 1 1 7 25.481 50.962 0.279 8.36 4 16.2 2.0
61 0 4 5 25.92 51.84 0.284 8.04 4 62.5 28.9
62 1 1 -8 26.564 53.127 0.29 7.6 4 9.2 0.6
63 2 2 -6 26.69 53.379 0.292 7.52 4 2.8 0.1
64 1 3 6 26.92 53.84 0.294 7.38 4 35.5 8.6
65 1 5 0 27.153 54.307 0.296 7.23 4 17.7 2.1
66 2 4 -1 27.176 54.353 0.296 7.22 4 37.8 9.5
67 3 1 -1 27.188 54.375 0.297 7.21 4 54.2 19.5
68 1 5 -1 27.223 54.447 0.297 7.19 4 39.0 10.1
69 2 4 0 27.24 54.48 0.297 7.18 4 38.4 9.7
70 3 1 0 27.385 54.769 0.299 7.09 4 36.9 8.9
71 2 2 5 27.394 54.788 0.299 7.09 4 11.6 0.9
72 3 1 -2 27.397 54.794 0.299 7.09 4 12.9 1.1
73 1 5 1 27.49 54.98 0.3 7.03 4 38.6 9.7
74 2 4 -2 27.519 55.038 0.3 7.02 4 78.6 39.8
75 0 2 8 27.608 55.216 0.301 6.97 4 53.0 18.0
76 1 5 -2 27.698 55.395 0.302 6.91 4 25.8 4.2
77 2 4 1 27.708 55.417 0.302 6.91 4 19.0 2.3
78 2 0 6 27.806 55.612 0.303 6.85 2 96.5 29.3
79 1 3 -7 27.826 55.653 0.303 6.84 4 148.2 138.2
80 3 1 1 27.983 55.965 0.305 6.75 4 76.4 36.3
81 3 1 -3 28.007 56.014 0.305 6.74 4 17.7 2.0
82 0 4 6 28.171 56.341 0.306 6.65 4 3.2 0.1
83 1 5 2 28.223 56.446 0.307 6.63 4 37.1 8.4
84 2 4 -3 28.258 56.515 0.307 6.61 4 54.3 17.9
85 1 5 -3 28.563 57.126 0.31 6.45 4 22.7 3.1
86 2 4 2 28.567 57.135 0.31 6.45 4 89.6 47.6
87 1 1 8 28.682 57.364 0.312 6.39 4 5.6 0.2
88 3 1 2 28.965 57.93 0.314 6.25 4 40.8 9.6
89 3 1 -4 29.001 58.002 0.315 6.23 4 27.2 4.2
90 2 2 -7 29.033 58.067 0.315 6.21 4 39.5 8.9
91 1 5 3 29.333 58.667 0.318 6.07 4 38.7 8.4
92 2 4 -4 29.373 58.747 0.318 6.05 4 12.6 0.9
93 1 3 7 29.633 59.265 0.321 5.94 4 99.6 54.1
94 2 0 -8 29.696 59.392 0.322 5.91 2 64.5 11.3
95 2 4 3 29.796 59.592 0.323 5.86 4 30.1 4.9
96 1 5 -4 29.798 59.595 0.323 5.86 4 11.6 0.7
97 1 1 -9 29.817 59.634 0.323 5.85 4 52.1 14.6
98 2 2 6 29.821 59.642 0.323 5.85 4 6.9 0.3
99 3 1 3 30.308 60.616 0.328 5.64 4 14.0 1.0
100 3 1 -5 30.355 60.71 0.328 5.62 4 85.6 37.9
101 1 3 -8 30.616 61.232 0.331 5.52 4 7.9 0.3
102 0 4 7 30.688 61.375 0.331 5.49 4 82.7 34.5
103 1 5 4 30.796 61.593 0.332 5.45 4 46.2 10.7
104 2 4 -5 30.841 61.682 0.333 5.43 4 39.6 7.8
105 0 2 9 30.912 61.824 0.333 5.4 4 28.4 4.0
106 0 6 0 31.129 62.258 0.336 5.32 2 123.1 37.1
107 3 3 -1 31.187 62.374 0.336 5.3 4 112.8 62.0
108 0 6 1 31.316 62.632 0.337 5.25 4 48.4 11.3
109 3 3 0 31.368 62.736 0.338 5.23 4 9.1 0.4
110 2 4 4 31.368 62.737 0.338 5.23 4 56.1 15.1
111 1 5 -5 31.376 62.751 0.338 5.23 4 34.7 5.8
112 3 3 -2 31.379 62.759 0.338 5.23 4 25.3 3.1
113 2 2 -8 31.635 63.271 0.34 5.13 4 67.6 21.6
114 0 6 2 31.873 63.746 0.343 5.05 4 47.7 10.6
115 3 3 1 31.919 63.838 0.343 5.03 4 31.5 4.6
116 3 3 -3 31.941 63.883 0.343 5.03 4 56.1 14.6
117 3 1 4 31.987 63.974 0.344 5.01 4 46.0 9.7
118 1 1 9 32.038 64.075 0.344 4.99 4 56.7 14.8
119 3 1 -6 32.043 64.087 0.344 4.99 4 15.4 1.1
120 2 2 7 32.5 64.999 0.349 4.84 4 46.7 9.7
121 0 0 10 32.529 65.059 0.349 4.83 2 97.4 21.1
122 1 3 8 32.566 65.133 0.349 4.82 4 36.4 5.9
123 1 5 5 32.586 65.172 0.35 4.81 4 52.3 12.1
124 2 4 -6 32.635 65.27 0.35 4.8 4 68.4 20.6
125 0 6 3 32.789 65.579 0.352 4.75 4 33.9 5.0
126 3 3 2 32.829 65.658 0.352 4.74 4 34.7 5.2
127 3 3 -4 32.863 65.725 0.352 4.73 4 8.5 0.3
128 1 1 -10 33.228 66.457 0.356 4.62 4 15.5 1.0
129 2 4 5 33.26 66.519 0.356 4.61 4 16.1 1.1
130 1 5 -6 33.272 66.545 0.356 4.6 4 18.1 1.4
131 0 4 8 33.45 66.901 0.358 4.55 4 76.6 24.6
132 2 0 8 33.595 67.19 0.359 4.51 2 40.8 3.4
133 1 3 -9 33.624 67.248 0.359 4.5 4 100.3 41.6
134 3 1 5 33.977 67.954 0.363 4.4 4 58.7 14.0
135 3 1 -7 34.043 68.086 0.363 4.39 4 48.3 9.4
136 0 6 4 34.051 68.102 0.363 4.39 4 78.1 24.6
137 3 3 3 34.084 68.169 0.364 4.38 4 91.2 33.5
138 3 3 -5 34.128 68.256 0.364 4.36 4 71.2 20.3
139 0 2 10 34.379 68.759 0.367 4.3 4 19.8 1.5
140 2 2 -9 34.479 68.958 0.367 4.27 4 26.1 2.7
141 1 5 6 34.68 69.361 0.369 4.22 4 8.4 0.3
142 2 4 -7 34.733 69.466 0.37 4.21 4 60.6 14.2
143 2 2 8 35.417 70.835 0.376 4.05 4 66.0 16.2
144 2 4 6 35.45 70.899 0.376 4.04 4 39.6 5.8
145 1 5 -7 35.467 70.934 0.377 4.04 4 17.9 1.2
146 1 1 10 35.562 71.124 0.378 4.01 4 26.8 2.7
147 0 6 5 35.641 71.282 0.378 4.0 4 43.0 6.8
148 3 3 4 35.668 71.337 0.378 3.99 4 17.0 1.1
149 1 3 9 35.717 71.433 0.379 3.98 4 148.6 80.8
150 3 3 -6 35.722 71.444 0.379 3.98 4 28.0 2.9
151 2 0 -10 35.785 71.569 0.38 3.97 2 124.5 28.3
152 3 1 6 36.261 72.522 0.384 3.86 4 64.5 14.8
153 3 1 -8 36.335 72.671 0.385 3.85 4 28.1 2.8
154 0 4 9 36.451 72.902 0.386 3.83 4 65.1 14.9
155 2 6 -1 36.695 73.391 0.388 3.78 4 45.2 7.1
156 2 6 0 36.749 73.499 0.388 3.77 4 121.7 51.3
157 1 1 -11 36.816 73.633 0.389 3.75 4 24.6 2.1
158 4 0 -2 36.828 73.656 0.389 3.75 2 43.5 3.3
159 1 3 -10 36.85 73.7 0.389 3.75 4 24.7 2.1
160 2 6 -2 36.987 73.973 0.391 3.72 4 36.9 4.7
161 4 0 0 37.044 74.088 0.391 3.71 2 90.2 13.9
162 1 5 7 37.064 74.127 0.391 3.71 4 4.7 0.1
163 2 4 -8 37.12 74.24 0.392 3.7 4 54.0 9.9
164 2 6 1 37.148 74.297 0.392 3.69 4 36.2 4.5
165 0 6 6 37.545 75.09 0.396 3.62 4 75.7 19.1
166 2 2 -10 37.561 75.122 0.396 3.62 4 45.1 6.8
167 3 3 5 37.567 75.134 0.396 3.62 4 50.4 8.4
168 2 6 -3 37.62 75.24 0.396 3.61 4 22.1 1.6
169 3 3 -7 37.63 75.26 0.396 3.61 4 110.7 40.7
170 2 6 2 37.888 75.776 0.399 3.56 4 112.4 41.4
171 2 4 7 37.925 75.85 0.399 3.56 4 24.9 2.0
172 1 5 -8 37.947 75.895 0.399 3.55 4 5.3 0.1
173 4 0 -4 37.987 75.973 0.4 3.55 2 92.0 13.8
174 0 2 11 38.032 76.063 0.4 3.54 4 45.6 6.8
175 1 7 0 38.437 76.873 0.404 3.47 4 95.2 28.9
176 3 5 -1 38.465 76.93 0.404 3.47 4 66.2 14.0
177 1 7 -1 38.495 76.99 0.404 3.46 4 68.8 15.1
178 4 2 -1 38.523 77.046 0.404 3.46 4 40.8 5.3
179 2 2 9 38.575 77.151 0.405 3.45 4 40.1 5.1
180 4 2 -2 38.586 77.173 0.405 3.45 4 83.4 22.1
181 2 6 -4 38.59 77.181 0.405 3.45 4 91.8 26.7
182 4 0 2 38.626 77.252 0.405 3.44 2 106.4 17.9
183 3 5 0 38.63 77.26 0.405 3.44 4 49.9 7.9
184 3 5 -2 38.64 77.281 0.405 3.44 4 10.5 0.3
185 1 7 1 38.718 77.436 0.406 3.43 4 66.5 14.0
186 4 2 0 38.799 77.598 0.407 3.42 4 47.9 7.2
187 3 1 7 38.828 77.656 0.407 3.41 4 38.4 4.6
188 1 7 -2 38.893 77.786 0.408 3.41 4 18.9 1.1
189 3 1 -9 38.911 77.823 0.408 3.4 4 61.6 11.9
190 2 6 3 38.962 77.924 0.408 3.39 4 20.9 1.4
191 4 2 -3 38.989 77.978 0.408 3.39 4 43.7 5.9
192 1 3 10 39.093 78.186 0.409 3.38 4 29.3 2.7
193 3 5 1 39.133 78.267 0.41 3.37 4 36.9 4.2
194 3 5 -3 39.154 78.308 0.41 3.37 4 23.4 1.7
195 1 1 11 39.282 78.564 0.411 3.35 4 43.5 5.8
196 1 7 2 39.337 78.674 0.411 3.34 4 53.2 8.7
197 4 2 1 39.413 78.825 0.412 3.33 4 7.3 0.2
198 1 7 -3 39.627 79.254 0.414 3.3 4 29.5 2.7
199 0 4 10 39.695 79.39 0.415 3.29 4 49.8 7.5
200 4 2 -4 39.728 79.456 0.415 3.29 4 11.9 0.4
201 1 5 8 39.729 79.458 0.415 3.29 4 5.4 0.1
202 0 6 7 39.753 79.507 0.415 3.29 4 18.5 1.0
203 3 3 6 39.77 79.539 0.415 3.28 4 7.6 0.2
204 2 4 -9 39.789 79.579 0.415 3.28 4 43.4 5.7
205 3 3 -8 39.842 79.684 0.416 3.27 4 16.4 0.8
206 2 6 -5 39.89 79.781 0.416 3.27 4 40.6 5.0
207 3 5 2 39.972 79.943 0.417 3.26 4 35.3 3.7
208 3 5 -4 40.003 80.005 0.417 3.25 4 46.4 6.4
209 0 0 12 40.187 80.373 0.419 3.23 2 68.2 6.9
210 2 0 10 40.272 80.543 0.42 3.22 2 65.6 6.4
211 1 7 3 40.29 80.58 0.42 3.22 4 18.8 1.0
212 1 3 -11 40.309 80.618 0.42 3.22 4 49.2 7.2
213 4 2 2 40.36 80.719 0.42 3.21 4 74.6 16.4
214 2 6 4 40.364 80.727 0.42 3.21 4 37.2 4.1
215 4 0 -6 40.481 80.962 0.421 3.2 2 46.1 3.1
216 1 1 -12 40.612 81.224 0.423 3.18 4 43.1 5.4
217 2 4 8 40.683 81.366 0.423 3.17 4 78.0 17.7
218 1 7 -4 40.693 81.387 0.423 3.17 4 52.2 7.9
219 1 5 -9 40.71 81.42 0.423 3.17 4 10.3 0.3
220 4 2 -5 40.799 81.598 0.424 3.16 4 26.9 2.1
221 2 2 -11 40.892 81.784 0.425 3.15 4 7.0 0.1
222 3 5 3 41.14 82.281 0.427 3.12 4 39.3 4.4
223 3 5 -5 41.181 82.363 0.427 3.12 4 59.4 10.1
224 2 6 -6 41.514 83.027 0.43 3.08 4 55.2 8.6
225 4 0 4 41.528 83.056 0.43 3.08 2 47.2 3.2
226 1 7 4 41.571 83.143 0.431 3.08 4 53.5 8.1
227 4 2 3 41.636 83.271 0.431 3.07 4 32.6 3.0
228 3 1 8 41.68 83.36 0.432 3.07 4 9.3 0.2
229 3 1 -10 41.772 83.544 0.432 3.06 4 32.3 2.9
230 0 2 12 41.905 83.809 0.434 3.05 4 44.2 5.5
231 2 2 10 41.989 83.978 0.434 3.04 4 28.2 2.2
232 1 7 -5 42.087 84.174 0.435 3.03 4 55.6 8.6
233 2 6 5 42.087 84.175 0.435 3.03 4 29.4 2.4
234 4 2 -6 42.197 84.394 0.436 3.02 4 48.9 6.6
235 0 6 8 42.264 84.527 0.437 3.01 4 14.6 0.6
236 3 3 7 42.274 84.549 0.437 3.01 4 49.5 6.8
237 3 3 -9 42.356 84.712 0.437 3.01 4 32.6 2.9
238 3 5 4 42.635 85.271 0.44 2.98 4 31.5 2.7
239 1 5 9 42.681 85.363 0.44 2.98 4 41.0 4.6
240 3 5 -6 42.686 85.373 0.44 2.98 4 9.0 0.2
241 1 3 11 42.72 85.441 0.44 2.98 4 10.0 0.3
242 2 4 -10 42.746 85.492 0.441 2.97 4 7.3 0.1
243 2 0 -12 42.795 85.59 0.441 2.97 2 25.0 0.9
244 1 7 5 43.178 86.356 0.444 2.94 4 37.7 3.8
245 0 4 11 43.203 86.406 0.444 2.94 4 22.2 1.3
246 4 2 4 43.237 86.474 0.445 2.94 4 65.4 11.5
247 1 1 12 43.238 86.476 0.445 2.94 4 25.0 1.7
248 2 6 -7 43.458 86.916 0.446 2.92 4 31.8 2.7
249 0 8 0 43.574 87.148 0.447 2.91 2 5.0 0.0
250 4 4 -1 43.682 87.363 0.448 2.91 4 52.8 7.4
251 2 4 9 43.733 87.466 0.449 2.9 4 48.3 6.2
252 0 8 1 43.74 87.479 0.449 2.9 4 13.0 0.5
253 4 4 -2 43.744 87.487 0.449 2.9 4 43.1 5.0
254 1 5 -10 43.765 87.53 0.449 2.9 4 1.4 0.0
255 1 7 -6 43.805 87.61 0.449 2.9 4 25.7 1.8
256 4 2 -7 43.92 87.84 0.45 2.89 4 46.5 5.7
257 4 4 0 43.951 87.902 0.451 2.89 4 21.3 1.2
258 1 3 -12 44.032 88.063 0.451 2.88 4 18.2 0.9
259 2 6 6 44.132 88.265 0.452 2.88 4 91.1 22.0
260 4 4 -3 44.137 88.274 0.452 2.88 4 37.9 3.8
261 0 8 2 44.237 88.474 0.453 2.87 4 11.5 0.4
262 4 0 -8 44.269 88.537 0.453 2.87 2 106.5 14.9
263 3 5 5 44.455 88.911 0.455 2.86 4 50.9 6.8
264 2 2 -12 44.499 88.998 0.455 2.85 4 41.3 4.5
265 3 5 -7 44.516 89.033 0.455 2.85 4 29.6 2.3
266 4 4 1 44.552 89.104 0.455 2.85 4 23.5 1.4
267 1 1 -13 44.662 89.324 0.456 2.85 4 5.2 0.1
268 3 1 9 44.83 89.66 0.458 2.84 4 36.3 3.4
269 4 4 -4 44.862 89.724 0.458 2.84 4 21.2 1.2
270 3 1 -11 44.931 89.863 0.458 2.83 4 35.5 3.3
X-ray diffraction powder data (I)...X-Ray wave length = 1.54056 (angs.):
No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si)
( degree ) (angstrem) *100 *100
1 0 0 2 6.174 12.348 7.16231 959.9 100.0 100.0 5.6
2 0 2 0 9.923 19.846 4.47 64.7 6.7 6.7 5.6
3 1 1 0 9.992 19.984 4.43937 514.7 53.6 53.4 5.6
4 1 1 -1 10.157 20.315 4.36789 756.8 78.8 78.4 5.6
5 0 2 1 10.4 20.8 4.26707 20.5 2.1 2.1 5.6
6 1 1 1 10.766 21.533 4.12346 538.8 56.1 55.8 5.6
7 1 1 -2 11.222 22.445 3.95792 168.5 17.6 17.4 5.6
8 0 2 2 11.72 23.44 3.79208 358.6 37.4 37.1 5.6
9 1 1 2 12.312 24.624 3.61237 155.5 16.2 16.1 5.6
10 0 0 4 12.421 24.842 3.58115 675.4 70.4 69.8 5.6
11 1 1 -3 12.978 25.956 3.42989 40.9 4.3 4.2 5.6
12 0 2 3 13.653 27.307 3.26323 11.2 1.2 1.2 5.6
13 1 1 -4 15.204 30.408 2.93713 14.1 1.5 1.5 5.6
14 0 2 4 15.998 31.997 2.79484 30.0 3.1 3.1 5.6
15 1 1 4 16.844 33.688 2.65829 57.4 6.0 5.9 5.7
16 2 0 0 17.53 35.061 2.55726 261.2 27.2 26.8 5.7
17 1 1 -5 17.746 35.492 2.52715 72.2 7.5 7.4 5.7
18 1 3 1 17.882 35.764 2.50857 66.6 6.9 6.8 5.7
19 1 3 -2 18.172 36.344 2.46984 14.2 1.5 1.5 5.7
20 0 0 6 18.823 37.645 2.38744 70.8 7.4 7.2 5.7
21 1 3 2 18.894 37.788 2.37874 11.4 1.2 1.2 5.7
22 1 3 -3 19.354 38.707 2.32433 245.2 25.5 25.0 5.7
23 1 1 5 19.542 39.083 2.30283 61.4 6.4 6.3 5.7
24 2 2 0 20.305 40.611 2.21969 24.8 2.6 2.5 5.7
25 1 3 3 20.375 40.749 2.21244 150.8 15.7 15.4 5.7
26 2 0 -4 20.427 40.854 2.20703 67.6 7.0 6.9 5.7
27 0 4 2 21.164 42.327 2.13354 14.8 1.5 1.5 5.7
28 0 2 6 21.455 42.91 2.10589 42.6 4.4 4.3 5.7
29 2 2 -3 21.562 43.124 2.09598 37.4 3.9 3.8 5.7
30 2 2 2 21.938 43.877 2.06173 18.9 2.0 1.9 5.7
31 0 4 3 22.367 44.733 2.02422 16.1 1.7 1.6 5.7
32 1 1 6 22.431 44.861 2.01874 12.6 1.3 1.3 5.7
33 2 2 -4 22.907 45.814 1.97896 50.1 5.2 5.1 5.7
34 1 3 -5 22.97 45.94 1.97382 55.6 5.8 5.6 5.7
35 0 4 4 23.97 47.94 1.89604 33.5 3.5 3.4 5.7
36 1 3 5 24.447 48.894 1.86123 61.4 6.4 6.2 5.7
37 2 0 -6 24.506 49.012 1.85705 32.2 3.4 3.2 5.7
38 2 2 -5 24.633 49.267 1.84803 20.3 2.1 2.0 5.7
39 2 2 4 25.244 50.487 1.80619 24.3 2.5 2.4 5.8
40 0 0 8 25.479 50.959 1.79058 30.4 3.2 3.1 5.8
41 0 4 5 25.92 51.84 1.7622 28.9 3.0 2.9 5.8
42 3 1 -1 27.188 54.375 1.68586 31.1 3.2 3.1 5.8
43 1 5 -1 27.223 54.447 1.68382 19.8 2.1 2.0 5.8
44 3 1 0 27.385 54.769 1.67466 10.8 1.1 1.1 5.8
45 1 5 1 27.49 54.98 1.66875 9.7 1.0 1.0 5.8
46 2 4 -2 27.519 55.038 1.66712 39.8 4.2 4.0 5.8
47 0 2 8 27.608 55.216 1.66218 18.0 1.9 1.8 5.8
48 1 3 -7 27.826 55.653 1.65016 167.5 17.4 16.8 5.8
49 3 1 1 27.983 55.965 1.64168 38.3 4.0 3.8 5.8
50 2 4 -3 28.258 56.515 1.62699 17.9 1.9 1.8 5.8
51 2 4 2 28.567 57.135 1.61082 50.7 5.3 5.1 5.8
52 1 3 7 29.633 59.265 1.55789 54.1 5.6 5.4 5.8
53 2 0 -8 29.696 59.392 1.55487 11.3 1.2 1.1 5.8
54 1 1 -9 29.817 59.634 1.54914 20.5 2.1 2.0 5.8
55 3 1 -5 30.355 60.71 1.52424 37.9 4.0 3.8 5.8
56 0 4 7 30.688 61.375 1.50929 34.5 3.6 3.4 5.8
57 1 5 4 30.796 61.593 1.50448 10.7 1.1 1.1 5.8
58 0 6 0 31.129 62.258 1.49 37.1 3.9 3.7 5.8
59 3 3 -1 31.187 62.374 1.4875 62.0 6.5 6.1 5.8
60 0 6 1 31.316 62.632 1.482 11.3 1.2 1.1 5.8
61 2 4 4 31.368 62.737 1.47978 24.0 2.5 2.4 5.9
62 2 2 -8 31.635 63.271 1.46856 21.6 2.2 2.1 5.9
63 0 6 2 31.873 63.746 1.45877 10.6 1.1 1.0 5.9
64 3 3 -3 31.941 63.883 1.45596 19.1 2.0 1.9 5.9
65 3 1 4 31.987 63.974 1.45411 9.7 1.0 1.0 5.9
66 1 1 9 32.038 64.075 1.45205 15.8 1.6 1.6 5.9
67 2 2 7 32.5 64.999 1.43363 9.7 1.0 1.0 5.9
68 0 0 10 32.529 65.059 1.43246 21.1 2.2 2.1 5.9
69 1 5 5 32.586 65.172 1.43024 18.0 1.9 1.8 5.9
70 2 4 -6 32.635 65.27 1.42834 20.6 2.2 2.0 5.9
71 0 4 8 33.45 66.901 1.39742 24.6 2.6 2.4 5.9
72 1 3 -9 33.624 67.248 1.39105 45.1 4.7 4.4 5.9
73 3 1 5 33.977 67.954 1.3783 14.0 1.5 1.4 5.9
74 0 6 4 34.051 68.102 1.37568 34.0 3.5 3.3 5.9
75 3 3 3 34.084 68.169 1.37449 33.5 3.5 3.3 5.9
76 3 3 -5 34.128 68.256 1.37294 20.3 2.1 2.0 5.9
77 2 4 -7 34.733 69.466 1.35195 14.2 1.5 1.4 5.9
78 2 2 8 35.417 70.835 1.32915 16.2 1.7 1.6 5.9
79 1 3 9 35.717 71.433 1.31948 83.7 8.7 8.2 5.9
80 2 0 -10 35.785 71.569 1.3173 28.3 2.9 2.8 5.9
81 3 1 6 36.261 72.522 1.30233 14.8 1.5 1.4 5.9
82 0 4 9 36.451 72.902 1.29647 14.9 1.6 1.5 6.0
83 2 6 0 36.749 73.499 1.28741 51.3 5.3 5.0 6.0
84 4 0 0 37.044 74.088 1.27863 14.0 1.5 1.4 6.0
85 2 4 -8 37.12 74.24 1.27638 14.4 1.5 1.4 6.0
86 0 6 6 37.545 75.09 1.26403 34.3 3.6 3.3 6.0
87 3 3 -7 37.63 75.26 1.2616 42.3 4.4 4.1 6.0
88 2 6 2 37.888 75.776 1.25428 41.4 4.3 4.0 6.0
89 4 0 -4 37.987 75.973 1.25152 13.8 1.4 1.3 6.0
90 1 7 0 38.437 76.873 1.2391 42.9 4.5 4.1 6.0
91 1 7 -1 38.495 76.99 1.23751 20.4 2.1 2.0 6.0
92 2 6 -4 38.59 77.181 1.23492 53.9 5.6 5.2 6.0
93 4 0 2 38.626 77.252 1.23396 26.2 2.7 2.5 6.0
94 1 7 1 38.718 77.436 1.23149 14.0 1.5 1.3 6.0
95 4 2 0 38.799 77.598 1.22932 11.8 1.2 1.1 6.0
96 3 1 -9 38.911 77.823 1.22633 13.0 1.4 1.3 6.0
97 4 2 2 40.36 80.719 1.18947 20.5 2.1 2.0 6.1
98 2 4 8 40.683 81.366 1.18164 26.0 2.7 2.5 6.1
99 3 5 -5 41.181 82.363 1.16985 10.1 1.1 1.0 6.1
100 2 6 -6 41.514 83.027 1.16216 11.8 1.2 1.1 6.1
101 1 7 -5 42.087 84.174 1.14923 11.0 1.1 1.0 6.1
102 4 2 4 43.237 86.474 1.12447 13.2 1.4 1.2 6.1
103 2 4 9 43.733 87.466 1.11425 11.6 1.2 1.1 6.2
104 2 6 6 44.132 88.265 1.10622 25.8 2.7 2.4 6.2
105 4 0 -8 44.269 88.537 1.10352 14.9 1.6 1.4 6.2
Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)
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