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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KYANITE
4, t-kyanite, at 600'C, f-kyanite
Al(2)[SiO(5)]
Triclinic P 1(-) Z = 4
R =0.036 NR =1741
12 .7 .1990
Ref.Str.:
Winter J.K., Chose S. (1979)
* Amer. Mineral., 64, 573-586
Reserv:
There are anisotropic factors in this article
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 7.1582 alpha = 89.9
b = 7.8821 beta = 101.21
c = 5.6089 gamma = 105.98
Unit cell volume (cub. angs.) = 297.98
Molar volume ( cub.cm/mol.) = 44.87
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.3263 0.7042 0.4586 0.0 Al = 1.00
2 0.2978 0.699 0.9507 0.0 Al = 1.00
3 0.1001 0.3858 0.6405 0.0 Al = 1.00
4 0.1131 0.9185 0.1659 0.0 Al = 1.00
5 0.1101 0.1469 0.1291 0.0 O = 1.00
6 0.1239 0.6868 0.1817 0.0 O = 1.00
7 0.2744 0.4542 0.956 0.0 O = 1.00
8 0.283 0.9358 0.9341 0.0 O = 1.00
9 0.1229 0.63 0.6396 0.0 O = 1.00
10 0.2814 0.4438 0.428 0.0 O = 1.00
11 0.2916 0.9483 0.467 0.0 O = 1.00
12 0.5004 0.2755 0.2443 0.0 O = 1.00
13 0.109 0.1524 0.6673 0.0 O = 1.00
14 0.5011 0.2303 0.755 0.0 O = 1.00
15 0.2961 0.065 0.7068 0.0 Si = 1.00
16 0.2908 0.3314 0.1893 0.0 Si = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.3263 0.7042 0.4586
2 2 0.2978 0.699 0.9507
3 3 0.1001 0.3858 0.6405
4 4 0.1131 0.9185 0.1659
5 5 0.1101 0.1469 0.1291
6 6 0.1239 0.6868 0.1817
7 7 0.2744 0.4542 0.956
8 8 0.283 0.9358 0.9341
9 9 0.1229 0.63 0.6396
10 10 0.2814 0.4438 0.428
11 11 0.2916 0.9483 0.467
12 12 0.5004 0.2755 0.2443
13 13 0.109 0.1524 0.6673
14 14 0.5011 0.2303 0.755
15 15 0.2961 0.065 0.7068
16 16 0.2908 0.3314 0.1893
17 1 0.6737 0.2958 0.5414
18 2 0.7022 0.301 0.0493
19 3 0.8999 0.6142 0.3595
20 4 0.8869 0.0815 0.8341
21 5 0.8899 0.8531 0.8709
22 6 0.8761 0.3132 0.8183
23 7 0.7256 0.5458 0.044
24 8 0.717 0.0642 0.0659
25 9 0.8771 0.37 0.3604
26 10 0.7186 0.5562 0.572
27 11 0.7084 0.0517 0.533
28 12 0.4996 0.7245 0.7557
29 13 0.891 0.8476 0.3327
30 14 0.4989 0.7697 0.245
31 15 0.7039 0.935 0.2932
32 16 0.7092 0.6686 0.8107
X-ray density (g/cm cub.) = 3.61
MU (1/cm) = 116.865 Mass attenuation coefficient (cm**2/g) = 32.365
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Al 2.316 6
1.8832 6
1.8964 9
1.9905 10
2.0084 11
1.8518 12
1.8576 14
2 Al 2.316 6
1.9489 6
1.891 7
1.8995 8
1.9202 9
1.9434 12
1.9352 14
3 Al 2.316 6
1.9374 7
1.8865 9
1.8939 10
1.863 13
2.0019 6
1.987 9
4 Al 2.316 6
1.8172 5
1.8503 6
1.9264 8
1.8807 11
2.0194 5
1.95 13
5 O 3.264 12
2.6571 7
2.6764 8
2.7249 10
2.8076 11
2.6442 12
3.0207 13
2.589 13
2.6569 5
2.762 6
2.6592 8
3.1656 9
2.8247 13
6 O 3.264 11
2.7839 7
2.5402 8
2.6073 9
3.0725 9
2.7244 10
2.4804 11
2.762 5
2.7134 7
2.9346 9
2.6114 13
2.5344 14
7 O 3.264 12
2.6571 5
2.7839 6
2.5132 9
2.6397 10
2.9733 10
2.7286 12
2.7203 13
3.0519 14
2.7134 6
3.0486 7
2.6842 12
2.8627 14
8 O 3.264 12
2.6764 5
2.5402 6
2.7584 9
2.9789 11
2.6336 11
3.0475 12
2.6726 13
2.7278 14
2.6592 5
2.9327 8
2.8653 12
2.6836 14
9 O 3.264 12
3.0725 6
2.6073 6
2.5132 7
2.7584 8
2.5092 10
2.7327 11
3.1656 5
2.9346 6
2.5889 9
2.7395 10
2.5422 12
3.0177 13
10 O 3.264 12
2.7249 5
2.7244 6
2.9733 7
2.6397 7
2.5092 9
2.6564 12
2.7699 13
2.999 14
2.7395 9
2.9537 10
2.7764 12
2.9131 14
11 O 3.264 12
2.8076 5
2.4804 6
2.6336 8
2.9789 8
2.7327 9
3.0063 12
2.7007 13
2.6522 14
2.817 11
2.9068 12
2.7073 13
2.7584 14
12 O 3.264 12
2.6442 5
2.7286 7
3.0475 8
2.6564 10
3.0063 11
2.8851 14
2.7692 14
2.6842 7
2.8653 8
2.5422 9
2.7764 10
2.9068 11
13 O 3.264 12
2.589 5
3.0207 5
2.7203 7
2.6726 8
2.7699 10
2.7007 11
2.648 14
2.8247 5
2.6114 6
3.0177 9
2.7073 11
2.9227 13
14 O 3.264 12
3.0519 7
2.7278 8
2.999 10
2.6522 11
2.7692 12
2.8851 12
2.648 13
2.5344 6
2.8627 7
2.6836 8
2.9131 10
2.7584 11
15 Si 2.1 4
1.6311 8
1.6209 11
1.6461 13
1.6487 14
16 Si 2.1 4
1.6426 5
1.6314 7
1.6291 10
1.6504 12
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 1 0 5.843 11.686 0.066 189.99 2 0.2 0.0
2 1 0 0 6.562 13.125 0.074 150.17 2 7.9 21.1
3 -1 1 0 7.47 14.94 0.084 115.37 2 7.7 15.3
4 0 0 1 8.06 16.12 0.091 98.78 2 0.2 0.0
5 -1 0 1 9.325 18.65 0.105 73.25 2 0.6 0.1
6 0 -1 1 9.712 19.424 0.11 67.36 2 0.1 0.0
7 1 1 0 9.965 19.931 0.112 63.87 2 15.1 32.8
8 0 1 1 10.238 20.477 0.115 60.39 2 25.9 91.0
9 -1 1 1 10.25 20.5 0.116 60.25 2 26.2 93.3
10 1 0 1 11.417 22.835 0.128 48.15 2 0.3 0.0
11 0 2 0 11.748 23.497 0.132 45.36 2 20.0 40.9
12 1 -1 1 11.749 23.497 0.132 45.36 2 10.8 11.9
13 -1 2 0 11.751 23.501 0.132 45.34 2 20.8 44.2
14 -1 -1 1 11.765 23.53 0.132 45.22 2 10.4 11.0
15 -2 1 0 12.863 25.726 0.145 37.49 2 19.5 32.0
16 2 0 0 13.213 26.425 0.148 35.43 2 73.4 429.6
17 1 1 1 13.891 27.783 0.156 31.86 2 58.5 245.9
18 -1 2 1 13.912 27.823 0.156 31.76 2 45.6 148.9
19 -2 1 1 13.918 27.837 0.156 31.73 2 61.3 268.5
20 0 -2 1 13.934 27.867 0.156 31.66 2 50.9 184.8
21 -2 0 1 14.054 28.109 0.158 31.08 2 6.4 2.9
22 0 2 1 14.684 29.367 0.165 28.31 2 33.7 72.6
23 1 -2 1 14.708 29.416 0.165 28.21 2 29.4 54.8
24 1 2 0 15.066 30.132 0.169 26.79 2 29.6 52.8
25 -2 2 0 15.071 30.142 0.169 26.77 2 31.6 60.1
26 2 1 0 15.965 31.93 0.179 23.65 2 13.1 9.1
27 -2 2 1 16.161 32.323 0.181 23.03 2 7.8 3.2
28 -1 -2 1 16.177 32.355 0.181 22.99 2 1.7 0.1
29 0 0 2 16.286 32.572 0.182 22.66 2 17.2 15.0
30 -1 0 2 16.3 32.599 0.182 22.61 2 17.1 14.8
31 2 -1 1 16.491 32.983 0.184 22.05 2 59.7 177.1
32 -2 -1 1 16.516 33.032 0.185 21.98 2 57.6 164.5
33 2 0 1 16.933 33.867 0.189 20.82 2 11.3 5.9
34 -1 1 2 17.027 34.055 0.19 20.57 2 24.7 28.3
35 0 -1 2 17.04 34.08 0.19 20.54 2 19.6 17.8
36 -1 3 0 17.132 34.264 0.191 20.3 2 23.4 25.1
37 0 1 2 17.671 35.341 0.197 18.97 2 62.0 164.3
38 -1 -1 2 17.709 35.417 0.197 18.88 2 49.6 104.8
39 0 3 0 17.783 35.567 0.198 18.71 2 63.7 171.1
40 1 2 1 18.13 36.259 0.202 17.93 2 17.0 11.6
41 2 -2 1 18.153 36.306 0.202 17.88 2 24.7 24.5
42 1 0 2 18.873 37.745 0.21 16.42 2 35.0 45.2
43 -1 3 1 18.877 37.753 0.21 16.41 2 0.7 0.0
44 -2 0 2 18.909 37.819 0.21 16.35 2 32.5 38.8
45 1 -1 2 18.939 37.877 0.211 16.29 2 59.1 128.2
46 -2 1 2 18.952 37.904 0.211 16.26 2 67.0 164.6
47 -2 3 0 19.037 38.073 0.212 16.11 2 62.3 140.6
48 1 -3 1 19.204 38.408 0.214 15.8 2 38.7 53.3
49 0 -3 1 19.208 38.416 0.214 15.79 2 39.2 54.6
50 -3 1 0 19.217 38.435 0.214 15.77 2 0.2 0.0
51 2 1 1 19.352 38.704 0.215 15.53 2 5.0 0.9
52 -3 1 1 19.386 38.771 0.215 15.47 2 6.7 1.5
53 -1 2 2 19.684 39.368 0.219 14.96 2 29.0 28.3
54 0 -2 2 19.718 39.435 0.219 14.9 2 23.9 19.1
55 3 0 0 20.05 40.101 0.223 14.36 2 23.2 17.4
56 0 3 1 20.059 40.119 0.223 14.34 2 24.8 19.9
57 -3 0 1 20.074 40.148 0.223 14.32 2 4.5 0.7
58 -2 3 1 20.075 40.15 0.223 14.32 2 25.9 21.6
59 2 2 0 20.25 40.499 0.225 14.04 2 33.0 34.5
60 -3 2 0 20.256 40.512 0.225 14.03 2 35.2 39.1
61 -3 2 1 20.554 41.109 0.228 13.58 2 28.0 24.1
62 -2 -2 1 20.565 41.129 0.228 13.57 2 34.4 36.2
63 1 1 2 20.675 41.349 0.229 13.41 2 37.0 41.3
64 -2 -1 2 20.731 41.461 0.23 13.33 2 47.2 66.8
65 1 3 0 20.784 41.567 0.23 13.25 2 47.4 67.0
66 0 2 2 20.823 41.646 0.231 13.19 2 13.3 5.3
67 -2 2 2 20.848 41.697 0.231 13.16 2 14.5 6.2
68 1 -2 2 20.858 41.716 0.231 13.14 2 8.5 2.2
69 -1 -2 2 20.878 41.756 0.231 13.12 2 10.8 3.5
70 2 -3 1 21.496 42.992 0.238 12.29 2 3.2 0.3
71 -1 -3 1 21.507 43.013 0.238 12.27 2 4.2 0.5
72 3 -1 1 22.45 44.9 0.248 11.14 2 43.5 47.4
73 -3 -1 1 22.478 44.956 0.248 11.11 2 42.5 45.1
74 3 1 0 22.583 45.167 0.249 10.99 2 4.0 0.4
75 2 -1 2 22.861 45.721 0.252 10.7 2 28.9 20.2
76 -3 1 2 22.893 45.786 0.253 10.66 2 17.6 7.4
77 -3 3 0 22.956 45.913 0.253 10.59 2 19.1 8.7
78 -1 4 0 23.011 46.021 0.254 10.54 2 118.9 335.5
79 2 2 1 23.226 46.452 0.256 10.32 2 32.3 24.3
80 3 -2 1 23.247 46.494 0.256 10.3 2 21.7 10.9
81 3 0 1 23.311 46.623 0.257 10.23 2 8.4 1.6
82 1 3 1 23.322 46.644 0.257 10.22 2 11.3 2.9
83 2 0 2 23.322 46.645 0.257 10.22 2 120.1 332.0
84 -3 3 1 23.35 46.7 0.257 10.19 2 13.0 3.9
85 -3 0 2 23.374 46.748 0.258 10.17 2 121.7 339.2
86 -1 3 2 23.726 47.451 0.261 9.83 2 2.1 0.1
87 0 -3 2 23.774 47.549 0.262 9.79 2 3.6 0.3
88 1 2 2 23.998 47.995 0.264 9.58 2 6.0 0.8
89 0 4 0 24.031 48.062 0.264 9.55 2 23.2 11.6
90 2 -2 2 24.031 48.062 0.264 9.55 2 10.8 2.5
91 -2 4 0 24.035 48.071 0.264 9.55 2 22.1 10.5
92 -3 2 2 24.043 48.085 0.264 9.54 2 5.6 0.7
93 -2 -2 2 24.067 48.134 0.265 9.52 2 9.6 2.0
94 -2 3 2 24.241 48.482 0.267 9.36 2 4.9 0.5
95 1 -3 2 24.269 48.538 0.267 9.34 2 7.8 1.3
96 -1 0 3 24.396 48.793 0.268 9.23 2 1.3 0.0
97 -1 4 1 24.523 49.045 0.269 9.12 2 25.9 13.8
98 1 -4 1 24.552 49.104 0.27 9.1 2 16.9 5.9
99 0 0 3 24.875 49.75 0.273 8.83 2 7.8 1.2
100 -2 4 1 25.022 50.043 0.275 8.71 2 1.8 0.1
101 -1 1 3 25.041 50.081 0.275 8.7 2 1.7 0.1
102 0 -4 1 25.046 50.092 0.275 8.69 2 1.3 0.0
103 0 3 2 25.203 50.406 0.276 8.57 2 0.8 0.0
104 -1 -3 2 25.269 50.538 0.277 8.52 2 2.8 0.2
105 0 -1 3 25.298 50.595 0.277 8.5 2 7.5 1.1
106 -1 -1 3 25.312 50.623 0.278 8.49 2 9.8 1.9
107 2 1 2 25.348 50.697 0.278 8.46 2 1.7 0.1
108 -3 -1 2 25.415 50.831 0.279 8.41 2 9.9 1.9
109 2 3 0 25.45 50.9 0.279 8.38 2 14.4 3.9
110 3 -3 1 25.584 51.167 0.28 8.28 2 4.6 0.4
111 -2 -3 1 25.599 51.199 0.28 8.27 2 3.0 0.2
112 3 1 1 25.703 51.406 0.282 8.2 2 62.6 72.2
113 -4 1 1 25.74 51.481 0.282 8.17 2 65.1 77.9
114 -2 0 3 25.871 51.741 0.283 8.08 2 11.4 2.4
115 0 4 1 25.971 51.941 0.284 8.0 2 12.1 2.6
116 0 1 3 25.988 51.976 0.284 7.99 2 22.1 8.8
117 2 -4 1 26.003 52.007 0.285 7.98 2 13.9 3.5
118 -2 1 3 26.018 52.036 0.285 7.97 2 19.5 6.8
119 -4 1 0 26.078 52.156 0.285 7.93 2 8.1 1.2
120 -4 2 1 26.218 52.437 0.287 7.83 2 13.5 3.2
121 -3 -2 1 26.225 52.45 0.287 7.83 2 5.6 0.5
122 3 2 0 26.432 52.863 0.289 7.69 2 1.7 0.1
123 -4 2 0 26.439 52.878 0.289 7.69 2 3.2 0.2
124 -3 3 2 26.664 53.327 0.291 7.54 2 13.8 3.3
125 2 -3 2 26.671 53.342 0.291 7.53 2 2.7 0.1
126 -4 0 1 26.763 53.526 0.292 7.48 2 10.2 1.8
127 1 4 0 26.92 53.841 0.294 7.38 2 1.1 0.0
128 -3 4 0 26.929 53.858 0.294 7.37 2 1.1 0.0
129 -1 2 3 27.164 54.328 0.296 7.23 2 29.8 14.5
130 1 -1 3 27.172 54.343 0.296 7.22 2 30.9 15.5
131 4 0 0 27.202 54.404 0.297 7.2 2 5.6 0.5
132 0 -2 3 27.204 54.408 0.297 7.2 2 43.0 30.0
133 -2 -1 3 27.212 54.423 0.297 7.2 2 31.8 16.4
134 1 0 3 27.232 54.464 0.297 7.19 2 10.0 1.6
135 -3 4 1 27.39 54.78 0.299 7.09 2 10.1 1.6
136 -1 -4 1 27.409 54.818 0.299 7.08 2 0.5 0.0
137 -2 2 3 27.637 55.273 0.301 6.95 2 22.2 7.7
138 -1 -2 3 27.674 55.348 0.301 6.93 2 25.1 9.8
139 2 3 1 28.107 56.214 0.306 6.69 2 1.1 0.0
140 -4 3 1 28.143 56.287 0.306 6.67 2 2.2 0.1
141 3 -1 2 28.154 56.308 0.306 6.66 2 45.6 31.2
142 -4 1 2 28.2 56.399 0.307 6.64 2 39.5 23.3
143 -4 3 0 28.246 56.493 0.307 6.61 2 36.4 19.7
144 1 3 2 28.446 56.891 0.309 6.51 2 19.9 5.8
145 0 2 3 28.508 57.017 0.31 6.48 2 7.9 0.9
146 -2 -3 2 28.524 57.049 0.31 6.47 2 12.2 2.2
147 1 -2 3 28.549 57.099 0.31 6.45 2 0.2 0.0
148 2 2 2 28.696 57.393 0.312 6.38 2 28.1 11.3
149 1 1 3 28.725 57.45 0.312 6.37 2 53.3 40.8
150 3 -2 2 28.728 57.456 0.312 6.36 2 36.3 18.9
151 -1 4 2 28.73 57.46 0.312 6.36 2 44.4 28.2
152 -2 4 2 28.741 57.482 0.312 6.36 2 45.0 29.0
153 -4 2 2 28.756 57.512 0.312 6.35 2 31.5 14.2
154 -3 -2 2 28.775 57.55 0.312 6.34 2 34.0 16.6
155 -3 1 3 28.781 57.561 0.313 6.34 2 56.3 45.2
156 1 -4 2 28.783 57.566 0.313 6.34 2 42.9 26.2
157 0 -4 2 28.79 57.579 0.313 6.33 2 41.7 24.8
158 3 0 2 28.995 57.991 0.315 6.23 2 12.3 2.1
159 -4 0 2 29.057 58.115 0.315 6.2 2 16.2 3.7
160 -3 0 3 29.085 58.17 0.316 6.19 2 2.4 0.1
161 4 -1 1 29.145 58.291 0.316 6.16 2 12.7 2.2
162 1 4 1 29.158 58.316 0.316 6.15 2 30.0 12.5
163 -4 -1 1 29.176 58.353 0.316 6.15 2 9.7 1.3
164 3 -4 1 29.192 58.384 0.317 6.14 2 25.8 9.2
165 -1 5 0 29.305 58.609 0.318 6.09 2 4.8 0.3
166 3 2 1 29.356 58.712 0.318 6.06 2 10.3 1.5
167 4 -2 1 29.376 58.752 0.318 6.05 2 12.3 2.1
168 4 1 0 29.696 59.393 0.322 5.91 2 2.4 0.1
169 -2 5 0 29.743 59.487 0.322 5.89 2 21.4 6.0
170 -3 2 3 29.869 59.739 0.323 5.83 2 20.1 5.3
171 -2 -2 3 29.903 59.806 0.324 5.82 2 13.6 2.4
172 4 0 1 30.296 60.592 0.327 5.65 2 21.1 5.6
173 0 -3 3 30.403 60.806 0.329 5.6 2 0.8 0.0
174 0 4 2 30.462 60.924 0.329 5.58 2 3.0 0.1
175 -3 4 2 30.494 60.987 0.329 5.57 2 0.0 0.0
176 1 -5 1 30.517 61.033 0.33 5.56 2 0.8 0.0
177 2 -4 2 30.517 61.034 0.33 5.56 2 10.3 1.3
178 -1 -4 2 30.537 61.074 0.33 5.55 2 4.6 0.3
179 -1 3 3 30.555 61.109 0.33 5.54 2 29.0 10.5
180 -2 3 3 30.569 61.138 0.33 5.54 2 28.9 10.4
181 0 5 0 30.6 61.199 0.33 5.52 2 53.1 35.1
182 3 -3 2 30.667 61.334 0.331 5.5 2 17.4 3.8
183 -4 3 2 30.677 61.354 0.331 5.49 2 7.3 0.7
184 2 -1 3 30.696 61.391 0.331 5.49 2 6.4 0.5
185 -1 5 1 30.696 61.392 0.331 5.49 2 51.0 32.1
186 -2 5 1 30.703 61.406 0.331 5.48 2 49.7 30.5
187 -3 -1 3 30.757 61.515 0.332 5.46 2 6.7 0.6
188 4 -3 1 30.97 61.939 0.334 5.38 2 7.5 0.7
189 -3 -3 1 30.989 61.978 0.334 5.37 2 0.4 0.0
190 2 0 3 31.175 62.351 0.336 5.3 2 14.9 2.7
191 3 1 2 31.18 62.36 0.336 5.3 2 53.3 33.9
192 1 -3 3 31.242 62.484 0.337 5.28 2 41.4 20.3
193 -4 -1 2 31.256 62.511 0.337 5.27 2 51.2 31.1
194 -1 -3 3 31.264 62.529 0.337 5.27 2 39.7 18.7
195 3 3 0 31.276 62.552 0.337 5.26 2 46.2 25.3
196 2 4 0 31.323 62.646 0.337 5.25 2 17.9 3.8
197 -4 4 0 31.335 62.67 0.338 5.24 2 18.5 4.0
198 -4 4 1 31.339 62.679 0.338 5.24 2 27.1 8.7
199 -2 -4 1 31.353 62.706 0.338 5.24 2 36.4 15.6
200 2 -5 1 31.363 62.727 0.338 5.23 2 55.3 36.1
201 0 -5 1 31.367 62.734 0.338 5.23 2 56.2 37.2
202 1 2 3 31.519 63.038 0.339 5.17 2 41.0 19.6
203 2 -2 3 31.56 63.119 0.34 5.16 2 16.8 3.3
204 -3 5 0 31.873 63.745 0.343 5.05 2 56.4 36.1
205 0 3 3 32.224 64.447 0.346 4.93 2 25.1 7.0
206 -3 3 3 32.265 64.531 0.347 4.92 2 23.4 6.0
207 0 5 1 32.369 64.737 0.348 4.88 2 1.2 0.0
208 -3 5 1 32.388 64.776 0.348 4.88 2 3.0 0.1
209 4 1 1 32.741 65.482 0.351 4.76 2 30.7 10.1
210 -5 1 1 32.782 65.565 0.351 4.75 2 32.1 11.0
211 -5 2 1 32.785 65.571 0.351 4.75 2 13.6 2.0
212 -4 -2 1 32.789 65.578 0.352 4.75 2 36.6 14.3
213 2 1 3 32.966 65.931 0.353 4.7 2 32.5 11.2
214 -4 1 3 33.042 66.085 0.354 4.67 2 37.6 14.9
215 2 3 2 33.121 66.242 0.355 4.65 2 12.1 1.5
216 -3 -3 2 33.21 66.419 0.356 4.62 2 3.7 0.1
217 -1 0 4 33.321 66.642 0.357 4.59 2 153.0 241.9
218 4 2 0 33.374 66.748 0.357 4.57 2 5.9 0.4
219 -5 2 0 33.382 66.765 0.357 4.57 2 11.6 1.4
220 -5 1 0 33.477 66.954 0.358 4.54 2 18.0 3.3
221 1 5 0 33.51 67.019 0.358 4.53 2 28.6 8.4
222 -4 2 3 33.648 67.296 0.36 4.5 2 30.3 9.3
223 -3 -2 3 33.678 67.355 0.36 4.49 2 21.7 4.8
224 2 -3 3 33.71 67.42 0.36 4.48 2 25.7 6.7
225 -4 0 3 33.73 67.46 0.36 4.47 2 7.8 0.6
226 -2 -3 3 33.753 67.506 0.361 4.47 2 24.7 6.2
227 1 4 2 33.777 67.554 0.361 4.46 2 140.4 198.1
228 2 4 1 33.778 67.557 0.361 4.46 2 2.3 0.1
229 4 -4 1 33.814 67.628 0.361 4.45 2 20.7 4.3
230 -4 4 2 33.827 67.654 0.361 4.45 2 142.7 204.0
231 3 -4 2 33.833 67.666 0.361 4.44 2 147.6 218.1
232 3 -5 1 33.835 67.671 0.361 4.44 2 25.9 6.7
233 -1 -5 1 33.842 67.685 0.361 4.44 2 21.8 4.8
234 -2 -4 2 33.864 67.728 0.362 4.44 2 148.5 220.2
235 -1 1 4 33.949 67.898 0.363 4.41 2 10.3 1.1
236 -1 -1 4 33.98 67.961 0.363 4.4 2 11.6 1.3
237 3 3 1 34.037 68.073 0.363 4.39 2 24.8 6.1
238 -5 0 1 34.071 68.142 0.364 4.38 2 9.2 0.8
239 -5 3 1 34.08 68.16 0.364 4.38 2 24.0 5.7
240 0 0 4 34.115 68.23 0.364 4.37 2 0.5 0.0
241 -2 5 2 34.117 68.233 0.364 4.37 2 16.5 2.7
242 -2 0 4 34.147 68.295 0.364 4.36 2 4.1 0.2
243 1 -5 2 34.17 68.341 0.365 4.35 2 11.6 1.3
244 0 -1 4 34.367 68.735 0.366 4.3 2 18.7 3.4
245 -2 1 4 34.368 68.737 0.366 4.3 2 8.8 0.8
246 4 -1 2 34.478 68.957 0.367 4.27 2 38.5 14.3
247 -1 5 2 34.508 69.016 0.368 4.27 2 32.1 9.9
248 -5 1 2 34.535 69.071 0.368 4.26 2 45.7 20.1
249 3 2 2 34.563 69.125 0.368 4.25 2 32.2 10.0
250 -5 3 0 34.57 69.14 0.368 4.25 2 41.6 16.6
251 0 -5 2 34.578 69.155 0.368 4.25 2 27.9 7.5
252 4 -2 2 34.593 69.186 0.369 4.24 2 27.6 7.3
253 -2 4 3 34.625 69.25 0.369 4.24 2 18.9 3.4
254 -5 2 2 34.634 69.269 0.369 4.23 2 31.4 9.4
255 -4 -2 2 34.65 69.3 0.369 4.23 2 27.4 7.2
256 0 -4 3 34.693 69.386 0.369 4.22 2 7.4 0.5
257 5 0 0 34.849 69.698 0.371 4.18 2 140.9 186.8
258 -1 4 3 35.01 70.021 0.372 4.14 2 1.1 0.0
259 1 -4 3 35.082 70.163 0.373 4.13 2 1.3 0.0
260 0 1 4 35.134 70.269 0.374 4.11 2 4.1 0.2
261 -2 -1 4 35.197 70.394 0.374 4.1 2 14.2 1.9
262 -3 5 2 35.326 70.652 0.375 4.07 2 18.3 3.1
263 2 -5 2 35.363 70.726 0.376 4.06 2 23.4 5.0
264 1 3 3 35.448 70.895 0.376 4.04 2 2.5 0.1
265 -4 3 3 35.514 71.028 0.377 4.03 2 4.1 0.1
266 -4 5 0 35.525 71.05 0.377 4.02 2 18.9 3.3
267 1 5 1 35.593 71.186 0.378 4.01 2 2.7 0.1
268 3 -1 3 35.594 71.187 0.378 4.01 2 39.4 14.0
269 -4 5 1 35.624 71.249 0.378 4.0 2 0.4 0.0
270 4 0 2 35.628 71.256 0.378 4.0 2 0.3 0.0
271 -4 -1 3 35.674 71.347 0.379 3.99 2 36.4 11.9
272 -5 0 2 35.699 71.398 0.379 3.98 2 0.6 0.0
273 -3 4 3 35.83 71.66 0.38 3.96 2 19.1 3.2
274 -1 2 4 35.833 71.665 0.38 3.96 2 18.3 3.0
275 -2 2 4 35.849 71.699 0.38 3.95 2 20.2 3.6
276 0 -2 4 35.879 71.757 0.38 3.95 2 8.4 0.6
277 -1 -4 3 35.893 71.787 0.381 3.94 2 2.6 0.1
278 -1 -2 4 35.894 71.787 0.381 3.94 2 8.5 0.6
279 2 2 3 35.966 71.932 0.381 3.93 2 2.7 0.1
280 4 -3 2 35.966 71.933 0.381 3.93 2 4.0 0.1
281 -5 3 2 35.992 71.983 0.381 3.92 2 0.8 0.0
282 3 -2 3 36.006 72.011 0.382 3.92 2 13.8 1.7
283 -1 6 0 36.094 72.188 0.382 3.9 2 17.5 2.7
284 -2 6 0 36.097 72.193 0.382 3.9 2 21.6 4.1
285 1 -1 4 36.334 72.669 0.385 3.85 2 11.9 1.2
286 4 2 1 36.347 72.694 0.385 3.85 2 17.7 2.7
287 5 -2 1 36.367 72.734 0.385 3.84 2 44.4 17.1
288 -3 1 4 36.367 72.734 0.385 3.84 2 14.4 1.8
289 3 0 3 36.431 72.863 0.385 3.83 2 0.3 0.0
290 0 5 2 36.477 72.954 0.386 3.82 2 13.3 1.5
291 1 0 4 36.48 72.96 0.386 3.82 2 45.8 18.1
292 -3 0 4 36.543 73.086 0.386 3.81 2 45.5 17.7
293 5 -1 1 36.552 73.104 0.387 3.81 2 0.1 0.0
294 -1 -5 2 36.561 73.121 0.387 3.8 2 2.3 0.0
295 -5 -1 1 36.587 73.173 0.387 3.8 2 0.5 0.0
296 -5 4 1 36.601 73.202 0.387 3.8 2 19.7 3.3
297 -3 -4 1 36.61 73.22 0.387 3.79 2 2.7 0.1
298 0 4 3 36.964 73.929 0.39 3.73 2 10.7 1.0
299 3 4 0 36.968 73.937 0.39 3.73 2 27.7 6.4
300 -5 4 0 36.983 73.966 0.39 3.72 2 33.2 9.2
301 2 -4 3 37.038 74.075 0.391 3.71 2 17.3 2.5
302 -2 6 1 37.063 74.125 0.391 3.71 2 26.1 5.7
303 1 -6 1 37.095 74.189 0.392 3.7 2 18.5 2.9
304 0 2 4 37.379 74.759 0.394 3.65 2 21.2 3.7
305 5 -3 1 37.42 74.839 0.394 3.64 2 35.5 10.4
306 1 -2 4 37.427 74.853 0.394 3.64 2 24.7 5.0
307 -3 2 4 37.429 74.858 0.395 3.64 2 20.5 3.5
308 5 1 0 37.435 74.87 0.395 3.64 2 24.1 4.8
309 -4 -3 1 37.443 74.885 0.395 3.64 2 36.7 11.0
310 -1 6 1 37.444 74.889 0.395 3.64 2 2.4 0.0
311 -2 -2 4 37.471 74.941 0.395 3.63 2 21.0 3.6
312 2 -6 1 37.482 74.963 0.395 3.63 2 6.3 0.3
313 0 6 0 37.65 75.301 0.397 3.6 2 12.8 1.3
314 3 -3 3 37.651 75.302 0.397 3.6 2 8.3 0.6
315 -3 6 0 37.658 75.317 0.397 3.6 2 15.1 1.8
316 -3 -3 3 37.713 75.426 0.397 3.59 2 7.1 0.4
317 4 -5 1 37.78 75.559 0.398 3.58 2 1.8 0.0
318 -2 -5 1 37.79 75.579 0.398 3.58 2 2.6 0.1
319 2 5 0 37.855 75.71 0.398 3.57 2 52.7 22.3
320 1 1 4 37.858 75.716 0.398 3.57 2 14.5 1.7
321 -3 -1 4 37.95 75.9 0.399 3.55 2 6.7 0.4
322 5 0 1 37.968 75.936 0.399 3.55 2 4.6 0.2
323 4 1 2 37.993 75.986 0.4 3.55 2 25.9 5.4
324 -4 5 2 38.07 76.14 0.4 3.53 2 4.1 0.1
325 -5 -1 2 38.077 76.155 0.4 3.53 2 19.9 3.2
326 4 3 0 38.088 76.175 0.4 3.53 2 27.7 6.1
327 3 -5 2 38.091 76.181 0.4 3.53 2 8.2 0.5
328 -3 6 1 38.23 76.46 0.402 3.51 2 19.9 3.1
329 0 -6 1 38.256 76.512 0.402 3.5 2 13.6 1.5
330 2 4 2 38.487 76.973 0.404 3.47 2 2.1 0.0
331 3 1 3 38.487 76.974 0.404 3.47 2 2.6 0.1
332 -2 3 4 38.53 77.061 0.404 3.46 2 22.5 3.9
333 4 -4 2 38.543 77.086 0.404 3.46 2 3.6 0.1
334 -5 4 2 38.553 77.106 0.405 3.46 2 0.4 0.0
335 -4 4 3 38.564 77.128 0.405 3.45 2 21.3 3.5
336 -5 1 3 38.583 77.166 0.405 3.45 2 2.0 0.0
337 -3 -4 2 38.585 77.169 0.405 3.45 2 5.2 0.2
338 0 -3 4 38.589 77.177 0.405 3.45 2 12.3 1.2
339 -2 -4 3 38.622 77.244 0.405 3.45 2 29.4 6.7
340 -5 2 3 38.77 77.54 0.406 3.42 2 17.7 2.4
341 -4 -2 3 38.796 77.592 0.407 3.42 2 2.1 0.0
342 -1 3 4 38.897 77.794 0.408 3.4 2 49.5 18.8
343 -1 -3 4 38.986 77.972 0.408 3.39 2 44.2 14.9
344 3 3 2 39.019 78.038 0.409 3.39 2 5.1 0.2
345 -4 -3 2 39.117 78.234 0.41 3.37 2 3.2 0.1
346 0 6 1 39.36 78.719 0.412 3.34 2 30.9 7.2
347 3 -6 1 39.402 78.804 0.412 3.33 2 21.5 3.5
348 -5 0 3 39.61 79.22 0.414 3.31 2 6.2 0.3
349 3 4 1 39.639 79.278 0.414 3.3 2 20.8 3.2
350 5 -4 1 39.676 79.351 0.414 3.3 2 4.3 0.1
351 -2 5 3 39.687 79.373 0.415 3.29 2 2.0 0.0
352 -3 3 4 39.694 79.387 0.415 3.29 2 44.0 14.3
353 1 -3 4 39.721 79.442 0.415 3.29 2 51.2 19.4
354 2 -1 4 39.79 79.58 0.415 3.28 2 1.7 0.0
355 -4 1 4 39.852 79.704 0.416 3.27 2 0.9 0.0
356 1 5 2 39.934 79.867 0.417 3.26 2 16.6 2.0
357 1 -5 3 39.954 79.908 0.417 3.26 2 42.3 13.2
358 0 -5 3 39.963 79.927 0.417 3.26 2 45.8 15.4
359 -2 -5 2 40.03 80.06 0.418 3.25 2 7.7 0.4
360 2 3 3 40.077 80.154 0.418 3.25 2 22.1 3.6
361 -5 3 3 40.166 80.332 0.419 3.23 2 17.1 2.1
362 2 5 1 40.223 80.446 0.419 3.23 2 13.7 1.4
363 -6 2 1 40.244 80.488 0.419 3.22 2 26.3 5.0
364 -5 -2 1 40.246 80.491 0.419 3.22 2 27.2 5.4
365 -5 5 1 40.265 80.53 0.42 3.22 2 12.9 1.2
366 2 0 4 40.311 80.621 0.42 3.22 2 22.6 3.7
367 -2 6 2 40.32 80.641 0.42 3.22 2 1.6 0.0
368 1 -6 2 40.386 80.771 0.421 3.21 2 9.6 0.7
369 -4 0 4 40.402 80.804 0.421 3.21 2 23.3 3.9
370 1 4 3 40.404 80.808 0.421 3.21 2 28.8 6.0
371 1 2 4 40.427 80.854 0.421 3.2 2 4.5 0.1
372 -1 5 3 40.433 80.865 0.421 3.2 2 58.1 24.3
373 -3 5 3 40.46 80.92 0.421 3.2 2 55.9 22.5
374 2 -2 4 40.475 80.95 0.421 3.2 2 10.2 0.8
375 3 -4 3 40.479 80.958 0.421 3.2 2 24.8 4.4
376 -4 2 4 40.507 81.015 0.422 3.19 2 4.5 0.1
377 -5 5 0 40.545 81.09 0.422 3.19 2 43.2 13.4
378 -3 -2 4 40.546 81.093 0.422 3.19 2 7.2 0.4
379 5 1 1 40.573 81.146 0.422 3.19 2 5.5 0.2
380 -6 1 1 40.62 81.239 0.423 3.18 2 5.8 0.2
381 1 6 0 40.705 81.411 0.423 3.17 2 10.4 0.8
382 -4 6 0 40.718 81.437 0.423 3.17 2 15.1 1.6
383 0 3 4 40.782 81.565 0.424 3.16 2 30.6 6.7
384 -2 -3 4 40.9 81.801 0.425 3.15 2 38.9 10.7
385 -4 6 1 40.904 81.808 0.425 3.15 2 34.6 8.5
386 -1 -6 1 40.925 81.85 0.425 3.15 2 27.3 5.3
387 4 3 1 41.019 82.038 0.426 3.14 2 12.5 1.1
388 -1 6 2 41.067 82.134 0.426 3.13 2 8.8 0.5
389 -6 3 1 41.07 82.14 0.426 3.13 2 11.7 1.0
390 -3 6 2 41.087 82.175 0.427 3.13 2 11.1 0.9
391 2 -6 2 41.137 82.275 0.427 3.12 2 8.5 0.5
392 0 -6 2 41.147 82.294 0.427 3.12 2 10.3 0.7
393 5 2 0 41.161 82.322 0.427 3.12 2 29.6 6.2
394 -6 2 0 41.171 82.341 0.427 3.12 2 25.6 4.6
395 2 -5 3 41.459 82.917 0.43 3.09 2 13.2 1.2
396 -1 -5 3 41.486 82.972 0.43 3.09 2 14.0 1.4
397 4 2 2 41.51 83.02 0.43 3.09 2 3.4 0.1
398 5 -2 2 41.54 83.081 0.43 3.08 2 7.9 0.4
399 -6 2 2 41.594 83.189 0.431 3.08 2 4.2 0.1
400 -5 -2 2 41.607 83.214 0.431 3.08 2 3.3 0.1
401 -6 1 0 41.635 83.27 0.431 3.07 2 2.0 0.0
402 3 2 3 41.708 83.416 0.432 3.07 2 32.3 7.2
403 4 -1 3 41.73 83.461 0.432 3.06 2 15.8 1.7
404 4 -2 3 41.748 83.495 0.432 3.06 2 12.3 1.0
405 5 -1 2 41.809 83.618 0.433 3.06 2 11.4 0.9
406 -5 -1 3 41.828 83.657 0.433 3.05 2 16.6 1.9
407 -6 1 2 41.877 83.755 0.433 3.05 2 14.2 1.4
408 -6 3 0 41.903 83.806 0.434 3.05 2 2.2 0.0
409 2 1 4 42.027 84.054 0.435 3.04 2 5.9 0.2
410 -4 -1 4 42.146 84.293 0.436 3.02 2 1.2 0.0
411 -6 0 1 42.191 84.382 0.436 3.02 2 10.6 0.8
412 -5 5 2 42.259 84.518 0.437 3.02 2 11.3 0.9
413 4 -5 2 42.264 84.527 0.437 3.01 2 4.5 0.1
414 -2 4 4 42.35 84.7 0.437 3.01 2 60.9 25.1
415 2 -3 4 42.352 84.705 0.437 3.01 2 16.5 1.9
416 -4 3 4 42.356 84.711 0.437 3.01 2 12.8 1.1
417 0 -4 4 42.436 84.873 0.438 3.0 2 77.0 40.0
418 5 -3 2 42.466 84.933 0.438 3.0 2 12.4 1.0
419 -6 3 2 42.506 85.011 0.439 2.99 2 10.9 0.8
420 0 5 3 42.681 85.362 0.44 2.98 2 21.0 3.0
421 -4 5 3 42.735 85.47 0.44 2.97 2 24.5 4.0
422 -5 4 3 42.744 85.489 0.441 2.97 2 11.3 0.9
423 1 6 1 42.755 85.51 0.441 2.97 2 25.8 4.4
424 -3 -4 3 42.798 85.595 0.441 2.97 2 3.7 0.1
425 4 -6 1 42.801 85.603 0.441 2.97 2 30.9 6.4
426 4 0 3 42.906 85.812 0.442 2.96 2 5.1 0.2
427 4 -3 3 42.958 85.916 0.442 2.96 2 25.7 4.4
428 -4 -3 3 43.038 86.075 0.443 2.95 2 28.1 5.3
429 -1 4 4 43.084 86.168 0.443 2.95 2 8.5 0.5
430 -6 4 1 43.085 86.171 0.443 2.95 2 1.0 0.0
431 -4 -4 1 43.09 86.181 0.443 2.95 2 16.2 1.7
432 5 -5 1 43.091 86.182 0.443 2.95 2 36.8 9.0
433 -3 -5 1 43.104 86.208 0.444 2.95 2 31.2 6.4
434 -3 4 4 43.118 86.235 0.444 2.95 2 11.2 0.8
435 1 -4 4 43.174 86.347 0.444 2.94 2 17.5 2.0
436 -1 -4 4 43.2 86.4 0.444 2.94 2 23.0 3.5
437 -2 7 0 43.211 86.421 0.444 2.94 2 2.0 0.0
438 5 0 2 43.269 86.537 0.445 2.93 2 28.0 5.2
439 6 0 0 43.29 86.581 0.445 2.93 2 1.6 0.0
440 0 6 2 43.313 86.626 0.445 2.93 2 3.1 0.1
441 -6 0 2 43.351 86.703 0.446 2.93 2 28.9 5.5
442 -4 6 2 43.354 86.707 0.446 2.93 2 4.0 0.1
443 3 -6 2 43.388 86.776 0.446 2.93 2 10.3 0.7
444 -1 -6 2 43.408 86.816 0.446 2.92 2 5.8 0.2
445 -1 0 5 43.409 86.817 0.446 2.92 2 0.1 0.0
446 3 5 0 43.538 87.077 0.447 2.91 2 13.0 1.1
447 -1 7 0 43.582 87.165 0.447 2.91 2 6.3 0.3
448 -2 0 5 43.802 87.604 0.449 2.9 2 8.7 0.5
449 4 4 0 43.806 87.612 0.449 2.9 2 59.3 22.9
450 -6 4 0 43.823 87.647 0.449 2.9 2 62.8 25.7
451 -1 -1 5 43.928 87.855 0.45 2.89 2 0.8 0.0
452 -1 1 5 44.078 88.157 0.452 2.88 2 17.3 1.9
453 -2 1 5 44.098 88.195 0.452 2.88 2 18.9 2.3
454 1 3 4 44.148 88.297 0.452 2.88 2 7.5 0.4
455 -2 7 1 44.226 88.452 0.453 2.87 2 1.6 0.0
456 -3 -3 4 44.295 88.591 0.453 2.87 2 12.3 1.0
457 5 2 1 44.331 88.661 0.454 2.86 2 19.9 2.6
458 -3 7 0 44.337 88.675 0.454 2.86 2 7.7 0.4
459 6 -2 1 44.351 88.703 0.454 2.86 2 11.7 0.9
460 2 -7 1 44.45 88.901 0.455 2.86 2 7.1 0.3
461 1 -7 1 44.451 88.902 0.455 2.86 2 6.4 0.3
462 3 -5 3 44.452 88.903 0.455 2.86 2 1.5 0.0
463 -2 -5 3 44.497 88.994 0.455 2.85 2 1.1 0.0
464 0 0 5 44.513 89.026 0.455 2.85 2 7.4 0.3
465 3 4 2 44.52 89.04 0.455 2.85 2 48.3 15.0
466 5 -4 2 44.578 89.157 0.456 2.85 2 46.4 13.8
467 -6 4 2 44.603 89.206 0.456 2.85 2 45.7 13.4
468 -4 -4 2 44.63 89.261 0.456 2.85 2 50.6 16.4
469 0 -1 5 44.658 89.316 0.456 2.85 2 22.6 3.3
470 3 -1 4 44.668 89.336 0.456 2.85 2 8.4 0.5
471 -2 -1 5 44.695 89.389 0.457 2.84 2 24.0 3.7
472 -5 1 4 44.759 89.519 0.457 2.84 2 3.5 0.1
473 2 5 2 44.814 89.629 0.458 2.84 2 5.5 0.2
474 6 -1 1 44.902 89.804 0.458 2.83 2 3.4 0.1
475 2 2 4 44.92 89.841 0.458 2.83 2 0.4 0.0
476 -3 -5 2 44.924 89.849 0.458 2.83 2 14.5 1.3
477 -6 -1 1 44.942 89.884 0.459 2.83 2 6.8 0.3
478 -1 7 1 44.968 89.935 0.459 2.83 2 17.0 1.8
479 3 -2 4 44.969 89.939 0.459 2.83 2 2.6 0.0
480 -3 7 1 44.981 89.963 0.459 2.83 2 11.6 0.9
481 6 -3 1 44.988 89.977 0.459 2.83 2 18.0 2.1
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 1 0 0 6.562 13.125 6.74013 21.1 2.5 2.5 5.6
2 -1 1 0 7.47 14.94 5.9248 15.3 1.8 1.8 5.6
3 1 1 0 9.965 19.931 4.45108 32.8 3.9 3.9 5.6
4 -1 1 1 10.25 20.5 4.3287 184.3 21.7 21.9 5.6
5 -1 2 0 11.751 23.501 3.78235 108.0 12.7 12.8 5.6
6 -2 1 0 12.863 25.726 3.46001 32.0 3.8 3.8 5.6
7 2 0 0 13.213 26.425 3.37006 429.6 50.7 50.7 5.6
8 -2 1 1 13.918 27.837 3.2023 848.1 100.0 100.0 5.6
9 0 2 1 14.684 29.367 3.03879 127.3 15.0 15.0 5.6
10 -2 2 0 15.071 30.142 2.9624 112.9 13.3 13.3 5.6
11 2 1 0 15.965 31.93 2.80051 9.1 1.1 1.1 5.6
12 0 0 2 16.286 32.572 2.74679 29.9 3.5 3.5 5.6
13 2 -1 1 16.491 32.983 2.71347 341.6 40.3 40.1 5.6
14 -1 1 2 17.027 34.055 2.63049 46.1 5.4 5.4 5.7
15 -1 3 0 17.132 34.264 2.61489 25.1 3.0 2.9 5.7
16 0 1 2 17.671 35.341 2.53761 164.3 19.4 19.2 5.7
17 -1 -1 2 17.709 35.417 2.53234 104.8 12.4 12.3 5.7
18 0 3 0 17.783 35.567 2.52203 171.1 20.2 20.0 5.7
19 2 -2 1 18.153 36.306 2.4724 36.2 4.3 4.2 5.7
20 1 0 2 18.873 37.745 2.38133 45.2 5.3 5.3 5.7
21 -2 0 2 18.909 37.819 2.37687 38.8 4.6 4.5 5.7
22 -2 1 2 18.952 37.904 2.37175 292.8 34.5 34.2 5.7
23 -2 3 0 19.037 38.073 2.36158 140.6 16.6 16.4 5.7
24 0 -3 1 19.208 38.416 2.34129 107.9 12.7 12.6 5.7
25 -1 2 2 19.684 39.368 2.28685 28.3 3.3 3.3 5.7
26 0 -2 2 19.718 39.435 2.28309 19.1 2.3 2.2 5.7
27 -2 3 1 20.075 40.15 2.24408 59.6 7.0 7.0 5.7
28 -3 2 0 20.256 40.512 2.22484 73.6 8.7 8.6 5.7
29 -2 -2 1 20.565 41.129 2.19287 60.3 7.1 7.0 5.7
30 1 1 2 20.675 41.349 2.18172 41.3 4.9 4.8 5.7
31 -2 -1 2 20.731 41.461 2.17608 66.8 7.9 7.8 5.7
32 1 3 0 20.784 41.567 2.17079 67.0 7.9 7.8 5.7
33 -2 2 2 20.848 41.697 2.16435 11.5 1.4 1.3 5.7
34 3 -1 1 22.45 44.9 2.0171 92.5 10.9 10.7 5.7
35 2 -1 2 22.861 45.721 1.98275 20.2 2.4 2.3 5.7
36 -3 3 0 22.956 45.913 1.97493 8.7 1.0 1.0 5.7
37 -1 4 0 23.011 46.021 1.97052 335.5 39.6 38.9 5.7
38 2 2 1 23.226 46.452 1.95326 35.2 4.2 4.1 5.7
39 2 0 2 23.322 46.645 1.94561 336.5 39.7 39.0 5.7
40 -3 0 2 23.374 46.748 1.94156 343.1 40.5 39.7 5.7
41 0 4 0 24.031 48.062 1.89152 25.3 3.0 2.9 5.7
42 -1 4 1 24.523 49.045 1.85586 13.8 1.6 1.6 5.7
43 3 1 1 25.703 51.406 1.77605 72.2 8.5 8.3 5.8
44 -4 1 1 25.74 51.481 1.77364 77.9 9.2 9.0 5.8
45 0 1 3 25.988 51.976 1.75788 11.4 1.4 1.3 5.8
46 -2 1 3 26.018 52.036 1.75602 10.3 1.2 1.2 5.8
47 1 -1 3 27.172 54.343 1.68678 30.0 3.5 3.4 5.8
48 0 -2 3 27.204 54.408 1.68493 48.0 5.7 5.5 5.8
49 -1 -2 3 27.674 55.348 1.65851 9.8 1.2 1.1 5.8
50 3 -1 2 28.154 56.308 1.63249 31.2 3.7 3.6 5.8
51 -4 1 2 28.2 56.399 1.63006 23.3 2.8 2.7 5.8
52 -4 3 0 28.246 56.493 1.62759 19.7 2.3 2.3 5.8
53 -2 4 2 28.741 57.482 1.60192 142.4 16.8 16.3 5.8
54 0 -4 2 28.79 57.579 1.59943 112.8 13.3 12.9 5.8
55 1 4 1 29.158 58.316 1.58098 14.8 1.7 1.7 5.8
56 3 -4 1 29.192 58.384 1.57928 10.5 1.2 1.2 5.8
57 -1 3 3 30.555 61.109 1.51523 20.9 2.5 2.4 5.8
58 0 5 0 30.6 61.199 1.51322 35.1 4.1 4.0 5.8
59 -1 5 1 30.696 61.392 1.50892 62.7 7.4 7.1 5.8
60 3 1 2 31.18 62.36 1.48781 36.5 4.3 4.1 5.8
61 -4 -1 2 31.256 62.511 1.48457 95.4 11.2 10.8 5.8
62 0 -5 1 31.367 62.734 1.47983 105.4 12.4 11.9 5.9
63 1 2 3 31.519 63.038 1.47342 19.6 2.3 2.2 5.9
64 -3 5 0 31.873 63.745 1.45877 36.1 4.3 4.1 5.9
65 4 1 1 32.741 65.482 1.42422 10.1 1.2 1.1 5.9
66 -4 -2 1 32.789 65.578 1.42237 27.3 3.2 3.1 5.9
67 2 1 3 32.966 65.931 1.4156 11.2 1.3 1.3 5.9
68 -4 1 3 33.042 66.085 1.41268 14.9 1.8 1.7 5.9
69 -1 0 4 33.321 66.642 1.40222 241.9 28.5 27.3 5.9
70 -4 2 3 33.648 67.296 1.39018 9.3 1.1 1.0 5.9
71 1 4 2 33.777 67.554 1.38549 204.3 24.1 23.0 5.9
72 -1 -5 1 33.842 67.685 1.38313 658.0 77.6 74.0 5.9
73 4 -1 2 34.478 68.957 1.36069 14.3 1.7 1.6 5.9
74 -5 1 2 34.535 69.071 1.35872 30.0 3.5 3.4 5.9
75 -5 3 0 34.57 69.14 1.35754 41.3 4.9 4.6 5.9
76 -4 -2 2 34.65 69.3 1.35479 20.0 2.4 2.2 5.9
77 5 0 0 34.849 69.698 1.34803 186.8 22.0 20.9 5.9
78 3 -1 3 35.594 71.187 1.32343 14.0 1.7 1.6 5.9
79 -4 -1 3 35.674 71.347 1.32085 11.9 1.4 1.3 5.9
80 -2 2 4 35.849 71.699 1.31524 9.8 1.2 1.1 5.9
81 5 -2 1 36.367 72.734 1.29906 22.8 2.7 2.5 6.0
82 1 0 4 36.48 72.96 1.29558 19.6 2.3 2.2 6.0
83 -3 0 4 36.543 73.086 1.29367 17.8 2.1 2.0 6.0
84 -5 4 0 36.983 73.966 1.28044 15.7 1.8 1.7 6.0
85 -4 -3 1 37.443 74.885 1.26698 38.6 4.5 4.3 6.0
86 2 5 0 37.855 75.71 1.25521 24.0 2.8 2.7 6.0
87 4 3 0 38.088 76.175 1.2487 9.8 1.2 1.1 6.0
88 -1 3 4 38.897 77.794 1.22671 18.8 2.2 2.1 6.0
89 -1 -3 4 38.986 77.972 1.22436 14.9 1.8 1.6 6.0
90 1 -3 4 39.721 79.442 1.20535 33.8 4.0 3.7 6.0
91 0 -5 3 39.963 79.927 1.19926 30.6 3.6 3.4 6.0
92 -5 -2 1 40.246 80.491 1.19226 13.0 1.5 1.4 6.0
93 -1 5 3 40.433 80.865 1.18769 56.9 6.7 6.2 6.1
94 -5 5 0 40.545 81.09 1.18496 14.0 1.7 1.5 6.1
95 -2 -3 4 40.9 81.801 1.17645 24.5 2.9 2.7 6.1
96 5 2 0 41.161 82.322 1.17032 10.8 1.3 1.2 6.1
97 3 2 3 41.708 83.416 1.15774 8.9 1.1 1.0 6.1
98 -2 4 4 42.35 84.7 1.14343 28.1 3.3 3.0 6.1
99 0 -4 4 42.436 84.873 1.14154 41.1 4.8 4.5 6.1
100 1 6 1 42.755 85.51 1.13466 9.3 1.1 1.0 6.1
101 -3 -5 1 43.104 86.208 1.12726 18.0 2.1 1.9 6.1
102 -6 4 0 43.823 87.647 1.11242 48.6 5.7 5.2 6.2
103 3 4 2 44.52 89.04 1.09859 15.0 1.8 1.6 6.2
104 5 -4 2 44.578 89.157 1.09745 27.3 3.2 2.9 6.2
105 -4 -4 2 44.63 89.261 1.09644 19.7 2.3 2.1 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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