Institute of Experimental Mineralogy
Russian Academy of Sciences
-------------------------------------------------
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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SILICATE_NA_BA_ND
1
NaBaNdSi(3)O(9)
Orthorhombic P 2(1)2(1)2(1) Z = 4
R =0.041 NR =1319
21 .3 .1994
Ref.Str.:
Malinovskii Iu.A., Bondareva O.S., Baturin S.V. (1984)
* Dokl. Akad. Nauk SSSR, 275, 2, 372-376
Reserv:
T.V.Ush.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.661 alpha = 90.0
b = 11.486 beta = 90.0
c = 12.591 gamma = 90.0
Unit cell volume (cub. angs.) = 818.7
Molar volume ( cub.cm/mol.) = 123.28
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0702 0.2879 0.1036 1.83 Na = 1.00
2 0.3957 0.3816 0.5805 1.14 Ba = 1.00
3 0.3834 0.0277 0.6397 0.98 Nd = 1.00
4 0.0973 0.3466 0.857 1.0 Si = 1.00
5 0.3994 0.3026 0.3124 1.0 Si = 1.00
6 0.1026 0.0863 0.8766 1.0 Si = 1.00
7 0.361 0.3727 0.815 1.3 O = 1.00
8 0.971 0.4385 0.9334 1.1 O = 1.00
9 0.41 0.1817 0.2436 1.2 O = 1.00
10 0.407 0.4049 0.2215 1.2 O = 1.00
11 0.126 0.1888 0.6107 1.2 O = 1.00
12 0.101 0.2198 0.9283 1.4 O = 1.00
13 0.992 0.4946 0.5372 1.0 O = 1.00
14 0.156 0.3155 0.3743 1.5 O = 1.00
15 0.358 0.057 0.8224 1.3 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0702 0.2879 0.1036
2 2 0.3957 0.3816 0.5805
3 3 0.3834 0.0277 0.6397
4 4 0.0973 0.3466 0.857
5 5 0.3994 0.3026 0.3124
6 6 0.1026 0.0863 0.8766
7 7 0.361 0.3727 0.815
8 8 0.971 0.4385 0.9334
9 9 0.41 0.1817 0.2436
10 10 0.407 0.4049 0.2215
11 11 0.126 0.1888 0.6107
12 12 0.101 0.2198 0.9283
13 13 0.992 0.4946 0.5372
14 14 0.156 0.3155 0.3743
15 15 0.358 0.057 0.8224
16 1 0.4298 0.7121 0.6036
17 2 0.1043 0.6184 0.0805
18 3 0.1166 0.9723 0.1397
19 4 0.4027 0.6534 0.357
20 5 0.1006 0.6974 0.8124
21 6 0.3974 0.9137 0.3766
22 7 0.139 0.6273 0.315
23 8 0.529 0.5615 0.4334
24 9 0.09 0.8183 0.7436
25 10 0.093 0.5951 0.7215
26 11 0.374 0.8112 0.1107
27 12 0.399 0.7802 0.4283
28 13 0.508 0.5054 0.0372
29 14 0.344 0.6845 0.8743
30 15 0.142 0.943 0.3224
31 1 0.9298 0.7879 0.3964
32 2 0.6043 0.8816 0.9195
33 3 0.6166 0.5277 0.8603
34 4 0.9027 0.8466 0.643
35 5 0.6006 0.8026 0.1876
36 6 0.8974 0.5863 0.6234
37 7 0.639 0.8727 0.685
38 8 0.029 0.9385 0.5666
39 9 0.59 0.6817 0.2564
40 10 0.593 0.9049 0.2785
41 11 0.874 0.6888 0.8893
42 12 0.899 0.7198 0.5717
43 13 0.008 0.9946 0.9628
44 14 0.844 0.8155 0.1257
45 15 0.642 0.557 0.6776
46 1 0.5702 0.2121 0.8964
47 2 0.8957 0.1184 0.4195
48 3 0.8834 0.4723 0.3603
49 4 0.5973 0.1534 0.143
50 5 0.8994 0.1974 0.6876
51 6 0.6026 0.4137 0.1234
52 7 0.861 0.1273 0.185
53 8 0.471 0.0615 0.0666
54 9 0.91 0.3183 0.7564
55 10 0.907 0.0951 0.7785
56 11 0.626 0.3112 0.3893
57 12 0.601 0.2802 0.0717
58 13 0.492 0.0054 0.4628
59 14 0.656 0.1845 0.6257
60 15 0.858 0.443 0.1776
X-ray density (g/cm cub.) = 4.32
MU (1/cm) = 916.921 Mass attenuation coefficient (cm**2/g) = 212.181
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Na 2.808 5
2.7649 10
2.3482 12
2.4199 7
2.6878 12
2.342 15
2 Ba 3.288 8
2.9611 7
2.7163 11
2.6843 13
3.026 14
2.8758 8
2.7385 15
2.8544 11
2.7603 14
3 Nd 2.82 6
2.3835 11
2.3298 15
2.364 7
2.4332 8
2.3243 13
2.3784 14
4 Si 2.1 4
1.6118 7
1.5971 8
1.711 12
1.6835 9
5 Si 2.1 4
1.6378 9
1.6409 10
1.59 14
1.6102 11
6 Si 2.1 4
1.6659 12
1.6338 15
1.6044 13
1.6619 10
7 O 3.264 6
2.7691 8
2.6992 12
3.1958 10
3.163 15
3.2548 9
2.7301 9
8 O 3.264 6
2.7691 7
2.6184 12
3.0279 13
2.9791 11
2.6442 9
3.141 15
9 O 3.264 7
2.5788 10
2.6716 14
2.7301 7
3.2548 7
2.6442 8
2.6595 11
2.6709 12
10 O 3.264 8
2.5788 9
2.6028 14
3.1958 7
2.6541 13
2.6756 11
2.6106 12
2.6487 15
3.1868 15
11 O 3.264 5
2.9791 8
2.6595 9
2.6756 10
3.0067 14
2.6678 14
12 O 3.264 6
2.6992 7
2.6184 8
2.7187 15
2.6752 13
2.6709 9
2.6106 10
13 O 3.264 5
3.0497 14
3.0279 8
2.6541 10
2.6752 12
2.7504 15
14 O 3.264 5
2.6716 9
2.6028 10
3.0497 13
2.6678 11
3.0067 11
15 O 3.264 6
2.7187 12
3.163 7
2.7504 13
3.141 8
3.1868 10
2.6487 10
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 1 5.208 10.416 0.059 239.74 4 75.0 804.6
2 0 0 2 7.028 14.056 0.079 130.64 2 6.5 1.7
3 0 2 0 7.708 15.416 0.087 108.23 2 139.4 628.0
4 0 1 2 8.021 16.041 0.091 99.79 4 75.8 341.8
5 0 2 1 8.477 16.955 0.096 89.09 4 11.0 6.5
6 1 0 1 8.58 17.16 0.097 86.92 4 74.7 289.1
7 1 1 0 8.725 17.451 0.098 83.98 4 49.8 124.4
8 1 1 1 9.414 18.828 0.106 71.83 8 52.8 239.0
9 0 2 2 10.46 20.92 0.118 57.77 4 10.3 3.7
10 1 0 2 10.544 21.088 0.119 56.82 4 133.1 600.7
11 1 2 0 11.015 22.029 0.124 51.89 4 104.1 335.3
12 1 1 2 11.238 22.477 0.127 49.76 8 126.5 949.7
13 0 1 3 11.268 22.536 0.127 49.49 4 0.5 0.0
14 1 2 1 11.573 23.146 0.13 46.81 8 154.6 1335.9
15 0 3 1 12.139 24.278 0.136 42.35 4 128.6 417.9
16 1 2 2 13.113 26.227 0.147 36.0 8 141.6 861.5
17 0 2 3 13.139 26.278 0.148 35.85 4 111.1 264.0
18 1 0 3 13.207 26.414 0.148 35.46 4 180.7 691.1
19 0 3 2 13.619 27.239 0.153 33.23 4 152.0 458.2
20 1 1 3 13.775 27.55 0.155 32.44 8 165.0 1054.0
21 1 3 0 14.057 28.113 0.158 31.07 4 240.6 1073.3
22 0 0 4 14.165 28.329 0.159 30.57 2 368.5 1238.4
23 1 3 1 14.505 29.01 0.163 29.06 8 244.4 2070.9
24 0 1 4 14.698 29.397 0.165 28.25 4 194.4 636.8
25 1 2 3 15.363 30.726 0.172 25.69 8 46.0 64.9
26 0 4 0 15.56 31.12 0.174 25.0 2 56.2 23.6
27 1 3 2 15.781 31.562 0.177 24.25 8 226.4 1483.5
28 2 0 0 15.791 31.583 0.177 24.22 2 175.2 221.9
29 0 3 3 15.803 31.605 0.177 24.18 4 31.1 14.0
30 0 4 1 15.97 31.94 0.179 23.63 4 79.3 88.7
31 2 0 1 16.196 32.392 0.181 22.93 4 303.9 1263.8
32 0 2 4 16.204 32.408 0.181 22.9 4 110.4 166.7
33 1 0 4 16.26 32.52 0.182 22.73 4 111.0 167.3
34 2 1 0 16.277 32.553 0.182 22.68 4 100.1 135.6
35 2 1 1 16.671 33.342 0.186 21.54 8 74.8 143.9
36 1 1 4 16.733 33.466 0.187 21.36 8 135.1 465.6
37 0 4 2 17.148 34.295 0.191 20.26 4 46.7 26.4
38 2 0 2 17.36 34.72 0.194 19.72 4 39.6 18.5
39 1 4 0 17.505 35.01 0.195 19.36 4 46.3 24.8
40 2 2 0 17.662 35.323 0.197 18.99 4 24.3 6.7
41 1 3 3 17.724 35.447 0.198 18.85 8 169.2 643.8
42 2 1 2 17.807 35.615 0.199 18.65 8 32.5 23.6
43 1 4 1 17.875 35.75 0.199 18.5 8 41.5 38.1
44 2 2 1 18.029 36.058 0.201 18.15 8 86.9 163.8
45 1 2 4 18.087 36.174 0.202 18.03 8 40.8 35.8
46 0 1 5 18.249 36.498 0.203 17.68 4 63.4 42.3
47 0 3 4 18.469 36.938 0.206 17.22 4 116.1 138.5
48 1 4 2 18.949 37.897 0.211 16.27 8 36.7 26.2
49 0 4 3 18.967 37.934 0.211 16.24 4 54.8 29.1
50 2 2 2 19.095 38.19 0.212 16.0 8 75.6 109.1
51 2 0 3 19.162 38.324 0.213 15.87 4 158.8 238.8
52 0 2 5 19.512 39.023 0.217 15.25 4 170.7 265.3
53 1 0 5 19.559 39.119 0.217 15.17 4 82.5 61.6
54 2 1 3 19.574 39.148 0.217 15.14 8 84.6 129.3
55 2 3 0 19.781 39.562 0.22 14.79 4 240.5 510.5
56 0 5 1 19.929 39.857 0.221 14.55 4 31.3 8.5
57 1 1 5 19.964 39.929 0.222 14.49 8 45.0 35.0
58 2 3 1 20.116 40.231 0.223 14.25 8 177.7 536.9
59 1 3 4 20.168 40.337 0.224 14.17 8 169.1 483.3
60 1 4 3 20.632 41.263 0.229 13.47 8 85.7 117.9
61 2 2 3 20.768 41.536 0.23 13.27 8 115.1 209.7
62 0 5 2 20.912 41.825 0.232 13.07 4 260.4 528.7
63 2 3 2 21.092 42.184 0.234 12.82 8 65.0 64.6
64 1 2 5 21.14 42.28 0.234 12.76 8 144.0 315.9
65 1 5 0 21.215 42.43 0.235 12.65 4 128.5 124.7
66 0 4 4 21.291 42.581 0.236 12.55 4 24.3 4.4
67 2 0 4 21.468 42.936 0.238 12.32 4 39.2 11.3
68 0 3 5 21.476 42.953 0.238 12.31 4 162.6 194.2
69 1 5 1 21.531 43.062 0.238 12.24 8 121.8 216.9
70 0 0 6 21.535 43.069 0.238 12.24 2 77.4 21.9
71 2 1 4 21.843 43.687 0.242 11.85 8 60.0 50.9
72 0 1 6 21.909 43.819 0.242 11.77 4 153.2 164.9
73 1 5 2 22.457 44.915 0.248 11.13 8 36.0 17.3
74 2 4 0 22.465 44.93 0.248 11.13 4 7.5 0.4
75 0 5 3 22.473 44.947 0.248 11.12 4 116.5 90.0
76 2 3 3 22.643 45.286 0.25 10.93 8 178.6 416.3
77 2 4 1 22.767 45.534 0.251 10.79 8 42.0 22.7
78 1 4 4 22.815 45.63 0.252 10.74 8 127.0 207.0
79 2 2 4 22.941 45.882 0.253 10.61 8 141.0 251.6
80 1 3 5 22.991 45.982 0.254 10.56 8 108.7 148.8
81 0 2 6 23.004 46.008 0.254 10.54 4 89.2 50.1
82 1 0 6 23.046 46.092 0.254 10.5 4 69.4 30.1
83 1 1 6 23.402 46.803 0.258 10.14 8 110.5 147.9
84 2 4 2 23.655 47.31 0.26 9.9 8 95.4 107.5
85 0 6 0 23.727 47.453 0.261 9.83 2 61.8 11.2
86 1 5 3 23.938 47.876 0.263 9.64 8 28.3 9.2
87 0 4 5 24.007 48.014 0.264 9.57 4 128.0 93.6
88 0 6 1 24.016 48.033 0.264 9.56 4 252.6 364.3
89 2 0 5 24.168 48.337 0.266 9.43 4 207.0 241.1
90 3 0 1 24.378 48.757 0.268 9.24 4 99.9 55.0
91 3 1 0 24.436 48.872 0.269 9.2 4 26.9 4.0
92 1 2 6 24.444 48.889 0.269 9.19 8 137.9 208.7
93 2 1 5 24.511 49.023 0.269 9.13 8 208.3 472.9
94 0 5 4 24.526 49.053 0.269 9.12 4 5.6 0.2
95 2 3 4 24.685 49.37 0.271 8.99 8 107.5 123.9
96 3 1 1 24.719 49.439 0.271 8.96 8 47.5 24.1
97 0 3 6 24.745 49.49 0.272 8.94 4 102.5 56.0
98 0 6 2 24.87 49.741 0.273 8.83 4 40.5 8.7
99 2 4 3 25.082 50.163 0.275 8.67 8 104.7 113.4
100 1 6 0 25.135 50.271 0.276 8.62 4 227.2 265.7
101 3 0 2 25.223 50.446 0.277 8.56 4 167.9 143.9
102 1 4 5 25.404 50.808 0.278 8.42 8 184.7 342.7
103 1 6 1 25.413 50.826 0.279 8.41 8 108.2 117.6
104 3 2 0 25.447 50.894 0.279 8.39 4 50.9 13.0
105 2 2 5 25.52 51.04 0.28 8.33 8 89.8 80.3
106 3 1 2 25.556 51.112 0.28 8.3 8 69.5 47.8
107 2 5 0 25.585 51.17 0.28 8.28 4 52.9 13.8
108 0 1 7 25.687 51.374 0.281 8.21 4 57.9 16.4
109 3 2 1 25.722 51.444 0.282 8.18 8 127.3 158.2
110 2 5 1 25.859 51.718 0.283 8.08 8 125.4 151.7
111 1 5 4 25.903 51.805 0.284 8.05 8 74.8 53.8
112 1 3 6 26.113 52.226 0.286 7.91 8 75.8 54.2
113 1 6 2 26.233 52.467 0.287 7.82 8 51.3 24.5
114 0 6 3 26.248 52.496 0.287 7.81 4 235.0 257.4
115 3 2 2 26.536 53.071 0.29 7.62 8 121.8 135.0
116 3 0 3 26.588 53.175 0.291 7.59 4 96.5 42.2
117 0 2 7 26.664 53.327 0.291 7.54 4 12.3 0.7
118 2 5 2 26.67 53.339 0.291 7.53 8 65.5 38.6
119 1 0 7 26.701 53.402 0.292 7.51 4 62.1 17.3
120 3 1 3 26.908 53.816 0.294 7.38 8 164.3 238.0
121 2 4 4 26.985 53.97 0.295 7.34 8 19.1 3.2
122 0 5 5 26.992 53.985 0.295 7.33 4 57.5 14.5
123 1 1 7 27.021 54.042 0.295 7.31 8 183.6 294.4
124 0 4 6 27.041 54.083 0.295 7.3 4 163.1 116.0
125 3 3 0 27.071 54.141 0.295 7.28 4 234.8 239.6
126 2 3 5 27.141 54.282 0.296 7.24 8 55.5 26.6
127 2 0 6 27.19 54.379 0.297 7.21 4 51.9 11.6
128 3 3 1 27.334 54.669 0.298 7.12 8 145.9 181.1
129 2 1 6 27.505 55.011 0.3 7.02 8 45.1 17.0
130 1 6 3 27.562 55.125 0.3 6.99 8 31.3 8.2
131 3 2 3 27.855 55.709 0.303 6.83 8 78.5 50.2
132 1 2 7 27.965 55.929 0.304 6.76 8 107.3 93.0
133 2 5 3 27.984 55.969 0.305 6.75 8 137.5 152.3
134 0 6 4 28.096 56.191 0.306 6.69 4 47.8 9.1
135 3 3 2 28.116 56.231 0.306 6.68 8 61.9 30.6
136 0 3 7 28.239 56.477 0.307 6.62 4 40.1 6.3
137 0 7 1 28.256 56.511 0.307 6.61 4 14.7 0.9
138 1 5 5 28.283 56.566 0.308 6.59 8 124.9 122.7
139 1 4 6 28.331 56.661 0.308 6.57 8 124.5 121.5
140 3 0 4 28.42 56.84 0.309 6.52 4 119.3 55.4
141 2 2 6 28.439 56.877 0.309 6.51 8 33.4 8.7
142 3 1 4 28.727 57.454 0.312 6.37 8 87.2 57.7
143 0 7 2 29.02 58.041 0.315 6.22 4 54.7 11.1
144 2 6 0 29.062 58.125 0.315 6.2 4 1.9 0.0
145 3 4 0 29.239 58.478 0.317 6.12 4 38.8 5.5
146 1 7 0 29.259 58.518 0.317 6.11 4 37.9 5.2
147 0 0 8 29.302 58.604 0.318 6.09 2 33.6 2.1
148 2 4 5 29.306 58.612 0.318 6.08 8 97.7 69.3
149 2 6 1 29.314 58.628 0.318 6.08 8 29.9 6.5
150 1 6 4 29.354 58.708 0.318 6.06 8 123.8 110.9
151 3 3 3 29.387 58.774 0.319 6.05 8 152.7 168.3
152 3 4 1 29.49 58.98 0.32 6.0 8 23.4 3.9
153 1 3 7 29.493 58.986 0.32 6.0 8 55.5 22.0
154 1 7 1 29.51 59.02 0.32 5.99 8 14.9 1.6
155 0 1 8 29.603 59.206 0.321 5.95 4 171.4 104.2
156 3 2 4 29.635 59.27 0.321 5.93 8 50.8 18.3
157 2 5 4 29.76 59.519 0.322 5.88 8 92.5 60.0
158 0 5 6 29.812 59.625 0.323 5.86 4 90.7 28.7
159 2 3 6 29.952 59.903 0.324 5.79 8 89.5 55.4
160 2 6 2 30.062 60.124 0.325 5.75 8 238.3 389.6
161 3 4 2 30.235 60.47 0.327 5.67 8 34.8 8.2
162 1 7 2 30.255 60.509 0.327 5.67 8 27.4 5.1
163 0 7 3 30.268 60.535 0.327 5.66 4 152.2 78.3
164 0 4 7 30.353 60.705 0.328 5.62 4 15.3 0.8
165 0 6 5 30.361 60.721 0.328 5.62 4 97.9 32.1
166 2 0 7 30.49 60.981 0.329 5.57 4 51.0 8.6
167 0 2 8 30.495 60.99 0.329 5.57 4 73.7 18.1
168 1 0 8 30.529 61.059 0.33 5.55 4 40.2 5.4
169 3 0 5 30.67 61.34 0.331 5.5 4 30.5 3.0
170 2 1 7 30.784 61.568 0.332 5.45 8 61.4 24.5
171 1 1 8 30.823 61.646 0.333 5.44 8 110.9 79.7
172 3 1 5 30.963 61.926 0.334 5.38 8 16.9 1.8
173 1 5 6 31.027 62.054 0.335 5.36 8 71.8 33.0
174 3 3 4 31.112 62.224 0.335 5.32 8 156.2 155.0
175 2 6 3 31.284 62.567 0.337 5.26 8 82.4 42.6
176 3 4 3 31.453 62.906 0.339 5.2 8 45.2 12.7
177 1 7 3 31.472 62.944 0.339 5.19 8 35.3 7.7
178 1 4 7 31.555 63.11 0.34 5.16 8 43.7 11.8
179 1 6 5 31.563 63.126 0.34 5.16 8 133.4 109.6
180 2 2 7 31.656 63.312 0.341 5.13 8 144.2 127.3
181 1 2 8 31.694 63.389 0.341 5.11 8 116.7 83.1
182 3 2 5 31.832 63.664 0.342 5.06 8 92.5 51.7
183 3 5 0 31.888 63.777 0.343 5.04 4 130.8 51.5
184 0 3 8 31.948 63.897 0.343 5.02 4 29.2 2.6
185 2 5 5 31.952 63.904 0.344 5.02 8 68.0 27.7
186 0 7 4 31.964 63.928 0.344 5.02 4 82.5 20.4
187 2 4 6 31.996 63.992 0.344 5.01 8 159.2 151.5
188 3 5 1 32.127 64.254 0.345 4.96 8 49.4 14.5
189 0 8 0 32.446 64.891 0.348 4.86 2 66.0 6.3
190 0 8 1 32.682 65.364 0.351 4.78 4 32.5 3.0
191 3 5 2 32.837 65.674 0.352 4.73 8 43.2 10.6
192 2 7 0 32.862 65.723 0.352 4.73 4 21.8 1.3
193 0 5 7 32.949 65.899 0.353 4.7 4 189.4 100.6
194 2 6 4 32.951 65.901 0.353 4.7 8 67.8 25.8
195 4 0 0 32.975 65.95 0.353 4.69 2 347.5 169.1
196 0 6 6 33.001 66.001 0.354 4.68 4 89.3 22.3
197 2 3 7 33.081 66.162 0.354 4.66 8 90.3 45.4
198 2 7 1 33.097 66.193 0.354 4.66 8 27.7 4.3
199 3 4 4 33.115 66.23 0.355 4.65 8 135.5 101.9
200 1 3 8 33.118 66.237 0.355 4.65 8 53.2 15.7
201 1 7 4 33.134 66.268 0.355 4.64 8 97.5 52.7
202 4 0 1 33.209 66.419 0.356 4.62 4 121.1 40.4
203 3 3 5 33.253 66.506 0.356 4.61 8 71.2 27.9
204 4 1 0 33.256 66.513 0.356 4.61 4 31.8 2.8
205 3 0 6 33.296 66.592 0.356 4.6 4 60.5 10.0
206 0 8 2 33.386 66.772 0.357 4.57 4 80.6 17.7
207 4 1 1 33.49 66.98 0.358 4.54 8 62.7 21.3
208 3 1 6 33.576 67.153 0.359 4.52 8 117.8 74.8
209 1 8 0 33.607 67.213 0.359 4.51 4 187.7 94.8
210 0 1 9 33.687 67.375 0.36 4.48 4 21.2 1.2
211 2 7 2 33.796 67.592 0.361 4.45 8 84.5 38.0
212 1 8 1 33.839 67.677 0.361 4.44 8 126.5 84.8
213 4 0 2 33.908 67.815 0.362 4.42 4 24.5 1.6
214 0 4 8 33.925 67.85 0.362 4.42 4 108.7 31.1
215 3 5 3 34.003 68.006 0.363 4.4 8 50.6 13.4
216 2 0 8 34.055 68.11 0.363 4.38 4 10.3 0.3
217 0 7 5 34.077 68.153 0.364 4.38 4 48.0 6.0
218 4 2 0 34.094 68.188 0.364 4.37 4 70.5 13.0
219 1 5 7 34.101 68.203 0.364 4.37 8 14.5 1.1
220 1 6 6 34.152 68.303 0.364 4.36 8 86.9 39.3
221 4 1 2 34.185 68.371 0.365 4.35 8 51.1 13.6
222 4 2 1 34.325 68.649 0.366 4.31 8 10.3 0.5
223 2 1 8 34.332 68.664 0.366 4.31 8 103.5 55.1
224 3 2 6 34.41 68.82 0.367 4.29 8 79.0 31.9
225 0 2 9 34.52 69.04 0.368 4.26 4 131.6 44.1
226 2 5 6 34.525 69.05 0.368 4.26 8 138.2 97.1
227 1 8 2 34.531 69.062 0.368 4.26 8 84.2 36.0
228 0 8 3 34.543 69.086 0.368 4.26 4 55.2 7.7
229 1 0 9 34.552 69.104 0.368 4.25 4 32.7 2.7
230 1 1 9 34.828 69.655 0.371 4.19 8 38.7 7.5
231 2 7 3 34.947 69.893 0.372 4.16 8 41.5 8.5
232 3 6 0 34.972 69.945 0.372 4.15 4 97.7 23.6
233 4 2 2 35.012 70.025 0.372 4.14 8 32.4 5.2
234 2 4 7 35.025 70.051 0.373 4.14 8 144.4 103.0
235 2 6 5 35.033 70.066 0.373 4.14 8 52.8 13.8
236 4 0 3 35.056 70.113 0.373 4.13 4 73.4 13.3
237 1 4 8 35.062 70.123 0.373 4.13 8 113.1 63.0
238 2 2 8 35.158 70.315 0.374 4.11 8 96.1 45.3
239 3 4 5 35.193 70.385 0.374 4.1 8 92.2 41.6
240 3 6 1 35.2 70.401 0.374 4.1 8 131.9 85.1
241 1 7 5 35.211 70.422 0.374 4.09 8 116.1 65.9
242 4 1 3 35.33 70.66 0.375 4.07 8 49.9 12.1
243 4 3 0 35.469 70.938 0.377 4.04 4 52.7 6.7
244 3 5 4 35.605 71.21 0.378 4.01 8 61.4 18.0
245 1 2 9 35.648 71.296 0.378 4.0 8 57.6 15.8
246 1 8 3 35.67 71.341 0.379 3.99 8 120.5 69.1
247 4 3 1 35.696 71.392 0.379 3.99 8 84.7 34.1
248 3 3 6 35.78 71.56 0.38 3.97 8 47.8 10.8
249 3 6 2 35.88 71.761 0.38 3.94 8 22.4 2.4
250 0 3 9 35.888 71.775 0.381 3.94 4 20.6 1.0
251 0 6 7 35.988 71.976 0.381 3.92 4 40.2 3.8
252 0 8 4 36.134 72.268 0.383 3.89 4 35.4 2.9
253 4 2 3 36.145 72.291 0.383 3.89 8 55.1 14.1
254 3 0 7 36.272 72.545 0.384 3.86 4 10.8 0.3
255 4 3 2 36.372 72.744 0.385 3.84 8 108.9 54.4
256 0 5 8 36.389 72.778 0.385 3.84 4 33.0 2.5
257 2 3 8 36.515 73.03 0.386 3.81 8 50.6 11.7
258 2 7 4 36.53 73.06 0.386 3.81 8 49.7 11.2
259 3 1 7 36.542 73.084 0.386 3.81 8 96.0 41.9
260 0 7 6 36.577 73.155 0.387 3.8 4 97.8 21.7
261 4 0 4 36.638 73.275 0.387 3.79 4 208.3 98.1
262 4 1 4 36.906 73.813 0.39 3.74 8 112.9 56.9
263 2 8 0 36.983 73.965 0.39 3.72 4 18.1 0.7
264 1 3 9 36.998 73.996 0.391 3.72 8 11.3 0.6
265 3 6 3 37.002 74.005 0.391 3.72 8 39.2 6.8
266 1 6 7 37.097 74.194 0.392 3.7 8 28.1 3.5
267 2 8 1 37.206 74.411 0.393 3.68 8 106.4 49.8
268 1 8 4 37.241 74.482 0.393 3.68 8 115.5 58.5
269 3 2 7 37.347 74.693 0.394 3.66 8 138.4 83.5
270 0 9 1 37.348 74.696 0.394 3.66 4 111.0 26.9
271 4 4 0 37.357 74.715 0.394 3.65 4 46.3 4.7
272 2 5 7 37.458 74.916 0.395 3.64 8 43.4 8.2
273 4 3 3 37.488 74.976 0.395 3.63 8 42.4 7.8
274 1 5 8 37.493 74.987 0.395 3.63 8 60.2 15.7
275 2 6 6 37.506 75.013 0.395 3.63 8 66.1 18.9
276 4 4 1 37.58 75.159 0.396 3.62 8 69.0 20.6
277 3 5 5 37.621 75.242 0.396 3.61 8 97.5 41.0
278 3 4 6 37.662 75.324 0.397 3.6 8 126.5 68.7
279 1 7 6 37.68 75.359 0.397 3.6 8 92.5 36.8
280 4 2 4 37.708 75.416 0.397 3.59 8 107.4 49.4
281 0 0 10 37.718 75.435 0.397 3.59 2 47.6 2.4
282 0 4 9 37.768 75.536 0.398 3.58 4 156.3 52.2
283 2 8 2 37.871 75.743 0.398 3.57 8 71.9 22.0
284 2 0 9 37.892 75.784 0.399 3.56 4 25.1 1.3
285 0 1 10 37.984 75.967 0.399 3.55 4 111.0 26.1
286 0 9 2 38.013 76.026 0.4 3.54 4 134.8 38.4
287 0 8 5 38.139 76.278 0.401 3.52 4 61.5 8.0
288 2 1 9 38.158 76.315 0.401 3.52 8 179.7 135.7
289 1 9 0 38.222 76.444 0.402 3.51 4 68.1 9.7
290 4 4 2 38.243 76.486 0.402 3.5 8 59.2 14.7
291 2 4 8 38.384 76.767 0.403 3.48 8 82.9 28.6
292 1 9 1 38.442 76.885 0.404 3.47 8 105.0 45.7
293 3 7 0 38.469 76.939 0.404 3.47 4 40.8 3.5
294 2 7 5 38.528 77.055 0.404 3.46 8 85.7 30.3
295 3 6 4 38.553 77.105 0.405 3.46 8 69.9 20.2
296 4 0 5 38.634 77.267 0.405 3.44 4 72.5 10.8
297 3 3 7 38.675 77.349 0.406 3.44 8 56.2 13.0
298 3 7 1 38.689 77.378 0.406 3.44 8 25.9 2.7
299 0 2 10 38.778 77.555 0.407 3.42 4 107.2 23.5
300 1 0 10 38.809 77.617 0.407 3.42 4 3.9 0.0
301 1 4 9 38.858 77.716 0.407 3.41 8 172.0 120.4
302 4 1 5 38.897 77.795 0.408 3.4 8 72.3 21.2
303 2 2 9 38.951 77.901 0.408 3.4 8 29.5 3.5
304 2 8 3 38.972 77.945 0.408 3.39 8 2.9 0.0
305 4 3 4 39.032 78.064 0.409 3.38 8 62.4 15.7
306 1 1 10 39.072 78.144 0.409 3.38 8 76.9 23.8
307 1 9 2 39.101 78.202 0.409 3.37 8 119.3 57.4
308 0 9 3 39.113 78.226 0.409 3.37 4 62.6 7.9
309 1 8 5 39.226 78.453 0.41 3.36 8 58.5 13.7
310 0 6 8 39.315 78.631 0.411 3.34 4 65.2 8.5
311 4 4 3 39.341 78.682 0.411 3.34 8 21.2 1.8
312 3 7 2 39.347 78.694 0.412 3.34 8 47.0 8.8
313 0 7 7 39.451 78.903 0.412 3.33 4 184.3 67.5
314 3 0 8 39.591 79.182 0.414 3.31 4 64.2 8.1
315 4 2 5 39.686 79.372 0.415 3.29 8 86.2 29.2
316 4 5 0 39.737 79.475 0.415 3.29 4 11.5 0.3
317 3 1 8 39.853 79.707 0.416 3.27 8 124.4 60.5
318 1 2 10 39.86 79.72 0.416 3.27 8 92.0 33.0
319 4 5 1 39.955 79.911 0.417 3.26 8 36.4 5.1
320 3 5 6 40.036 80.073 0.418 3.25 8 86.4 29.0
321 0 3 10 40.091 80.182 0.418 3.24 4 15.2 0.4
322 0 5 9 40.14 80.28 0.418 3.24 4 4.7 0.0
323 1 9 3 40.192 80.385 0.419 3.23 8 44.1 7.5
324 2 3 9 40.262 80.525 0.42 3.22 8 28.9 3.2
325 2 6 7 40.359 80.718 0.42 3.21 8 71.2 19.4
326 1 6 8 40.394 80.787 0.421 3.21 8 32.1 3.9
327 3 7 3 40.436 80.873 0.421 3.2 8 55.4 11.7
328 2 8 4 40.499 80.999 0.422 3.19 8 12.5 0.6
329 3 4 7 40.511 81.023 0.422 3.19 8 28.2 3.0
330 3 6 5 40.518 81.037 0.422 3.19 8 145.1 80.2
331 1 7 7 40.529 81.057 0.422 3.19 8 30.9 3.6
332 0 8 6 40.545 81.091 0.422 3.19 4 75.2 10.8
333 4 5 2 40.607 81.215 0.422 3.18 8 179.5 122.4
334 3 2 8 40.637 81.274 0.423 3.18 8 83.0 26.2
335 0 9 4 40.638 81.277 0.423 3.18 4 123.8 29.1
336 2 5 8 40.746 81.491 0.424 3.17 8 103.0 40.1
337 4 4 4 40.864 81.729 0.425 3.15 8 26.5 2.6
338 2 7 6 40.928 81.855 0.425 3.15 8 147.1 81.2
339 4 3 5 40.992 81.984 0.426 3.14 8 92.1 31.8
340 4 0 6 41.032 82.064 0.426 3.13 4 12.5 0.3
341 1 3 10 41.164 82.329 0.427 3.12 8 34.4 4.4
342 1 5 9 41.213 82.427 0.428 3.12 8 98.8 36.3
343 4 1 6 41.292 82.584 0.428 3.11 8 89.8 29.9
344 2 9 0 41.458 82.917 0.43 3.09 4 146.7 39.7
345 1 8 6 41.616 83.233 0.431 3.07 8 30.8 3.5
346 2 9 1 41.674 83.349 0.432 3.07 8 66.7 16.3
347 4 5 3 41.69 83.379 0.432 3.07 8 92.6 31.4
348 1 9 4 41.709 83.418 0.432 3.07 8 20.0 1.5
349 0 4 10 41.913 83.825 0.434 3.05 4 84.1 12.9
350 3 3 8 41.937 83.873 0.434 3.04 8 6.0 0.1
351 3 7 4 41.951 83.902 0.434 3.04 8 57.0 11.8
352 2 0 10 42.034 84.067 0.435 3.04 4 7.7 0.1
353 4 2 6 42.07 84.141 0.435 3.03 8 52.7 10.1
354 2 4 9 42.083 84.165 0.435 3.03 8 42.5 6.5
355 0 10 0 42.115 84.231 0.435 3.03 2 67.8 4.1
356 2 1 10 42.293 84.585 0.437 3.01 8 20.7 1.5
357 2 9 2 42.321 84.643 0.437 3.01 8 56.3 11.4
358 0 10 1 42.331 84.662 0.437 3.01 4 20.7 0.8
359 3 8 0 42.387 84.775 0.438 3.0 4 99.0 17.6
360 2 8 5 42.444 84.889 0.438 3.0 8 105.0 39.5
361 0 1 11 42.554 85.107 0.439 2.99 4 62.4 6.9
362 0 9 5 42.582 85.165 0.439 2.99 4 96.4 16.6
363 4 6 0 42.599 85.197 0.439 2.99 4 33.0 1.9
364 3 8 1 42.603 85.205 0.439 2.99 8 111.4 44.3
365 0 7 8 42.7 85.4 0.44 2.98 4 56.3 5.6
366 4 4 5 42.807 85.613 0.441 2.97 8 81.6 23.6
367 4 6 1 42.814 85.627 0.441 2.97 8 150.9 80.7
368 3 5 7 42.847 85.693 0.441 2.97 8 16.5 1.0
369 3 6 6 42.894 85.787 0.442 2.96 8 58.6 12.1
370 0 10 2 42.976 85.953 0.442 2.96 4 16.4 0.5
371 1 4 10 42.978 85.956 0.443 2.96 8 102.8 37.3
372 0 6 9 42.996 85.993 0.443 2.95 4 36.4 2.3
373 2 2 10 43.068 86.137 0.443 2.95 8 95.8 32.3
374 5 0 1 43.085 86.17 0.443 2.95 4 50.2 4.4
375 5 1 0 43.128 86.257 0.444 2.94 4 39.8 2.8
376 1 10 0 43.18 86.36 0.444 2.94 4 5.7 0.1
377 4 5 4 43.197 86.393 0.444 2.94 8 26.8 2.5
378 3 8 2 43.248 86.495 0.445 2.94 8 93.1 30.3
379 3 0 9 43.268 86.535 0.445 2.93 4 20.5 0.7
380 0 2 11 43.329 86.658 0.445 2.93 4 110.6 21.4
381 5 1 1 43.343 86.687 0.446 2.93 8 29.0 2.9
382 0 8 7 43.35 86.7 0.446 2.93 4 3.9 0.0
383 1 0 11 43.359 86.718 0.446 2.93 4 61.6 6.6
384 4 3 6 43.363 86.726 0.446 2.93 8 80.7 22.7
385 1 10 1 43.395 86.789 0.446 2.92 8 17.7 1.1
386 2 9 3 43.397 86.793 0.446 2.92 8 112.0 43.8
387 4 6 2 43.458 86.917 0.446 2.92 8 106.3 39.4
388 3 1 9 43.526 87.051 0.447 2.92 8 18.0 1.1
389 2 6 8 43.595 87.19 0.448 2.91 8 22.8 1.8
390 1 1 11 43.617 87.234 0.448 2.91 8 142.3 70.4
391 1 9 5 43.645 87.291 0.448 2.91 8 86.5 26.0
392 2 7 7 43.729 87.457 0.449 2.9 8 51.2 9.1
393 5 0 2 43.729 87.459 0.449 2.9 4 31.7 1.7
394 3 4 8 43.746 87.492 0.449 2.9 8 126.5 55.4
395 1 7 8 43.763 87.526 0.449 2.9 8 117.2 47.5
396 4 0 7 43.832 87.664 0.45 2.9 4 4.1 0.0
397 3 7 5 43.886 87.773 0.45 2.89 8 126.5 55.2
398 5 2 0 43.903 87.805 0.45 2.89 4 90.0 14.0
399 5 1 2 43.987 87.975 0.451 2.89 8 78.6 21.3
400 1 10 2 44.039 88.077 0.451 2.88 8 46.4 7.4
401 0 10 3 44.05 88.1 0.451 2.88 4 40.0 2.7
402 1 6 9 44.059 88.117 0.451 2.88 8 46.5 7.4
403 4 1 7 44.09 88.18 0.452 2.88 8 52.0 9.3
404 5 2 1 44.117 88.234 0.452 2.88 8 92.6 29.5
405 0 5 10 44.238 88.475 0.453 2.87 4 5.5 0.1
406 3 2 9 44.299 88.599 0.453 2.87 8 45.7 7.2
407 3 8 3 44.321 88.642 0.454 2.86 8 106.7 38.9
408 2 3 10 44.358 88.716 0.454 2.86 8 16.9 1.0
409 1 2 11 44.39 88.781 0.454 2.86 8 83.1 23.6
410 2 5 9 44.407 88.813 0.454 2.86 8 22.8 1.8
411 1 8 7 44.412 88.824 0.454 2.86 8 74.4 18.9
412 4 6 3 44.531 89.063 0.455 2.85 8 141.8 68.5
413 0 3 11 44.618 89.236 0.456 2.85 4 19.0 0.6
414 5 2 2 44.761 89.521 0.457 2.84 8 72.6 17.9
415 5 0 3 44.802 89.604 0.457 2.84 4 137.3 31.9
416 2 8 6 44.807 89.613 0.457 2.84 8 42.9 6.2
417 4 2 7 44.863 89.726 0.458 2.84 8 31.4 3.3
418 2 9 4 44.898 89.797 0.458 2.83 8 150.4 76.5
419 0 9 6 44.944 89.888 0.459 2.83 4 7.9 0.1
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 0 1 1 5.208 10.416 8.48564 804.6 38.9 39.3 5.6
2 0 2 0 7.708 15.416 5.743 628.0 30.3 30.6 5.6
3 0 1 2 8.021 16.041 5.52064 341.8 16.5 16.7 5.6
4 1 0 1 8.58 17.16 5.16315 289.1 14.0 14.1 5.6
5 1 1 0 8.725 17.451 5.07777 124.4 6.0 6.1 5.6
6 1 1 1 9.414 18.828 4.70924 239.0 11.5 11.6 5.6
7 1 0 2 10.544 21.088 4.20943 600.7 29.0 29.2 5.6
8 1 2 0 11.015 22.029 4.03161 335.3 16.2 16.3 5.6
9 1 1 2 11.238 22.477 3.95237 949.7 45.9 46.1 5.6
10 1 2 1 11.573 23.146 3.83958 1335.9 64.5 64.8 5.6
11 0 3 1 12.139 24.278 3.66306 417.9 20.2 20.3 5.6
12 1 2 2 13.113 26.227 3.3951 1125.5 54.4 54.5 5.6
13 1 0 3 13.207 26.414 3.37148 691.1 33.4 33.4 5.6
14 0 3 2 13.619 27.239 3.27122 458.2 22.1 22.2 5.6
15 1 1 3 13.775 27.55 3.235 1054.0 50.9 51.0 5.6
16 1 3 0 14.057 28.113 3.17144 1073.3 51.8 51.9 5.6
17 0 0 4 14.165 28.329 3.14775 1238.4 59.8 59.8 5.6
18 1 3 1 14.505 29.01 3.07538 2070.9 100.0 100.0 5.6
19 0 1 4 14.698 29.397 3.03581 636.8 30.8 30.7 5.6
20 1 2 3 15.363 30.726 2.90749 64.9 3.1 3.1 5.6
21 0 4 0 15.56 31.12 2.8715 23.6 1.1 1.1 5.6
22 1 3 2 15.781 31.562 2.83234 1719.3 83.0 82.8 5.6
23 0 4 1 15.97 31.94 2.79962 88.7 4.3 4.3 5.6
24 2 0 1 16.196 32.392 2.76158 1430.5 69.1 68.9 5.6
25 1 0 4 16.26 32.52 2.75106 302.8 14.6 14.6 5.6
26 2 1 1 16.671 33.342 2.68506 143.9 6.9 6.9 5.7
27 1 1 4 16.733 33.466 2.67539 465.6 22.5 22.4 5.7
28 0 4 2 17.148 34.295 2.61257 26.4 1.3 1.3 5.7
29 1 4 0 17.505 35.01 2.56089 24.8 1.2 1.2 5.7
30 1 3 3 17.724 35.447 2.53028 643.8 31.1 30.9 5.7
31 2 1 2 17.807 35.615 2.51874 23.6 1.1 1.1 5.7
32 1 4 1 17.875 35.75 2.50951 38.1 1.8 1.8 5.7
33 2 2 1 18.029 36.058 2.48879 163.8 7.9 7.9 5.7
34 1 2 4 18.087 36.174 2.48108 35.8 1.7 1.7 5.7
35 0 1 5 18.249 36.498 2.45978 42.3 2.0 2.0 5.7
36 0 3 4 18.469 36.938 2.43148 138.5 6.7 6.6 5.7
37 0 4 3 18.967 37.934 2.3699 55.3 2.7 2.6 5.7
38 2 2 2 19.095 38.19 2.35462 109.1 5.3 5.2 5.7
39 2 0 3 19.162 38.324 2.3467 238.8 11.5 11.4 5.7
40 0 2 5 19.512 39.023 2.30624 265.3 12.8 12.7 5.7
41 2 1 3 19.574 39.148 2.2992 190.9 9.2 9.1 5.7
42 2 3 0 19.781 39.562 2.27605 510.5 24.7 24.4 5.7
43 1 1 5 19.964 39.929 2.25601 35.0 1.7 1.7 5.7
44 2 3 1 20.116 40.231 2.23975 536.9 25.9 25.7 5.7
45 1 3 4 20.168 40.337 2.23412 483.3 23.3 23.1 5.7
46 1 4 3 20.632 41.263 2.18607 117.9 5.7 5.6 5.7
47 2 2 3 20.768 41.536 2.17234 209.7 10.1 10.0 5.7
48 0 5 2 20.912 41.825 2.15802 528.7 25.5 25.2 5.7
49 2 3 2 21.092 42.184 2.14045 64.6 3.1 3.1 5.7
50 1 2 5 21.14 42.28 2.1358 315.9 15.3 15.1 5.7
51 1 5 0 21.215 42.43 2.12862 124.7 6.0 5.9 5.7
52 0 3 5 21.476 42.953 2.10391 205.5 9.9 9.8 5.7
53 1 5 1 21.531 43.062 2.09884 238.7 11.5 11.4 5.7
54 2 1 4 21.843 43.687 2.07025 50.9 2.5 2.4 5.7
55 0 1 6 21.909 43.819 2.06433 164.9 8.0 7.9 5.7
56 0 5 3 22.473 44.947 2.0151 107.6 5.2 5.1 5.7
57 2 3 3 22.643 45.286 2.00078 416.3 20.1 19.8 5.7
58 2 4 1 22.767 45.534 1.99046 22.7 1.1 1.1 5.7
59 1 4 4 22.815 45.63 1.98651 207.0 10.0 9.8 5.7
60 2 2 4 22.941 45.882 1.97619 251.6 12.2 12.0 5.7
61 1 3 5 22.991 45.982 1.97212 198.9 9.6 9.4 5.7
62 1 0 6 23.046 46.092 1.96766 30.1 1.5 1.4 5.7
63 1 1 6 23.402 46.803 1.93941 147.9 7.1 7.0 5.7
64 2 4 2 23.655 47.31 1.91979 107.5 5.2 5.1 5.7
65 0 6 1 24.016 48.033 1.89258 457.9 22.1 21.7 5.7
66 2 0 5 24.168 48.337 1.8814 241.1 11.6 11.4 5.7
67 3 0 1 24.378 48.757 1.86616 55.0 2.7 2.6 5.7
68 1 2 6 24.444 48.889 1.86143 212.6 10.3 10.1 5.7
69 2 1 5 24.511 49.023 1.85666 473.1 22.8 22.4 5.7
70 2 3 4 24.685 49.37 1.8444 123.9 6.0 5.9 5.7
71 0 3 6 24.745 49.49 1.84021 80.2 3.9 3.8 5.7
72 2 4 3 25.082 50.163 1.81708 113.4 5.5 5.4 5.7
73 1 6 0 25.135 50.271 1.81345 265.7 12.8 12.6 5.8
74 3 0 2 25.223 50.446 1.80755 143.9 7.0 6.8 5.8
75 1 4 5 25.404 50.808 1.79554 460.3 22.2 21.7 5.8
76 2 2 5 25.52 51.04 1.7879 80.3 3.9 3.8 5.8
77 3 1 2 25.556 51.112 1.78557 47.8 2.3 2.3 5.8
78 3 2 1 25.722 51.444 1.77481 158.2 7.6 7.5 5.8
79 2 5 1 25.859 51.718 1.76605 151.7 7.3 7.2 5.8
80 1 5 4 25.903 51.805 1.76329 53.8 2.6 2.5 5.8
81 1 3 6 26.113 52.226 1.75007 54.2 2.6 2.6 5.8
82 0 6 3 26.248 52.496 1.74171 282.0 13.6 13.3 5.8
83 3 2 2 26.536 53.071 1.72417 135.0 6.5 6.4 5.8
84 3 0 3 26.588 53.175 1.72105 42.2 2.0 2.0 5.8
85 2 5 2 26.67 53.339 1.71613 38.6 1.9 1.8 5.8
86 3 1 3 26.908 53.816 1.70205 238.0 11.5 11.2 5.8
87 1 1 7 27.021 54.042 1.69548 428.1 20.7 20.1 5.8
88 3 3 0 27.071 54.141 1.69259 239.6 11.6 11.3 5.8
89 2 3 5 27.141 54.282 1.68854 26.6 1.3 1.3 5.8
90 3 3 1 27.334 54.669 1.6775 181.1 8.7 8.5 5.8
91 3 2 3 27.855 55.709 1.64861 50.2 2.4 2.4 5.8
92 2 5 3 27.984 55.969 1.64159 245.3 11.8 11.5 5.8
93 3 3 2 28.116 56.231 1.63454 39.7 1.9 1.9 5.8
94 1 5 5 28.283 56.566 1.62565 122.7 5.9 5.8 5.8
95 1 4 6 28.331 56.661 1.62315 121.5 5.9 5.7 5.8
96 3 0 4 28.42 56.84 1.61846 64.0 3.1 3.0 5.8
97 3 1 4 28.727 57.454 1.60263 57.7 2.8 2.7 5.8
98 2 6 1 29.314 58.628 1.57329 77.9 3.8 3.6 5.8
99 1 6 4 29.354 58.708 1.57134 110.9 5.4 5.2 5.8
100 3 3 3 29.387 58.774 1.56975 168.3 8.1 7.9 5.8
101 1 3 7 29.493 58.986 1.56459 27.6 1.3 1.3 5.8
102 0 1 8 29.603 59.206 1.5593 104.2 5.0 4.9 5.8
103 2 5 4 29.76 59.519 1.55185 60.0 2.9 2.8 5.8
104 0 5 6 29.812 59.625 1.54936 28.7 1.4 1.3 5.8
105 2 3 6 29.952 59.903 1.54282 55.4 2.7 2.6 5.8
106 2 6 2 30.062 60.124 1.53769 389.6 18.8 18.2 5.8
107 0 7 3 30.268 60.535 1.52822 78.3 3.8 3.6 5.8
108 0 6 5 30.361 60.721 1.52397 32.1 1.6 1.5 5.8
109 0 2 8 30.495 60.99 1.51791 26.7 1.3 1.2 5.8
110 2 1 7 30.784 61.568 1.50503 24.5 1.2 1.1 5.8
111 1 1 8 30.823 61.646 1.50332 79.7 3.9 3.7 5.8
112 1 5 6 31.027 62.054 1.4944 33.0 1.6 1.5 5.8
113 3 3 4 31.112 62.224 1.49074 155.0 7.5 7.2 5.8
114 2 6 3 31.284 62.567 1.48337 42.6 2.1 2.0 5.8
115 1 6 5 31.563 63.126 1.47158 121.3 5.9 5.6 5.9
116 2 2 7 31.656 63.312 1.4677 127.3 6.1 5.9 5.9
117 1 2 8 31.694 63.389 1.46612 83.1 4.0 3.9 5.9
118 3 2 5 31.832 63.664 1.46043 51.7 2.5 2.4 5.9
119 3 5 0 31.888 63.777 1.45813 51.5 2.5 2.4 5.9
120 0 7 4 31.964 63.928 1.45503 50.6 2.4 2.3 5.9
121 2 4 6 31.996 63.992 1.45375 151.5 7.3 7.0 5.9
122 4 0 0 32.975 65.95 1.41525 317.7 15.3 14.7 5.9
123 2 3 7 33.081 66.162 1.41123 49.6 2.4 2.3 5.9
124 3 4 4 33.115 66.23 1.40993 170.3 8.2 7.9 5.9
125 4 0 1 33.209 66.419 1.40639 40.4 2.0 1.9 5.9
126 3 3 5 33.253 66.506 1.40476 30.7 1.5 1.4 5.9
127 4 1 1 33.49 66.98 1.39597 21.3 1.0 1.0 5.9
128 3 1 6 33.576 67.153 1.39279 74.8 3.6 3.5 5.9
129 1 8 0 33.607 67.213 1.39169 94.8 4.6 4.4 5.9
130 2 7 2 33.796 67.592 1.3848 38.0 1.8 1.7 5.9
131 1 8 1 33.839 67.677 1.38326 84.8 4.1 3.9 5.9
132 0 4 8 33.925 67.85 1.38016 32.7 1.6 1.5 5.9
133 1 6 6 34.152 68.303 1.3721 39.3 1.9 1.8 5.9
134 2 1 8 34.332 68.664 1.36577 55.1 2.7 2.5 5.9
135 3 2 6 34.41 68.82 1.36305 31.9 1.5 1.5 5.9
136 2 5 6 34.525 69.05 1.35907 187.7 9.1 8.6 5.9
137 3 6 0 34.972 69.945 1.34387 32.2 1.6 1.5 5.9
138 2 6 5 35.033 70.066 1.34184 198.2 9.6 9.1 5.9
139 2 2 8 35.158 70.315 1.3377 45.3 2.2 2.1 5.9
140 1 7 5 35.211 70.422 1.33593 192.5 9.3 8.8 5.9
141 1 8 3 35.67 71.341 1.32096 119.0 5.7 5.5 5.9
142 4 3 2 36.372 72.744 1.2989 56.9 2.7 2.6 6.0
143 3 1 7 36.542 73.084 1.29369 64.8 3.1 3.0 6.0
144 0 7 6 36.577 73.155 1.29262 21.7 1.0 1.0 6.0
145 4 0 4 36.638 73.275 1.29079 98.1 4.7 4.5 6.0
146 4 1 4 36.906 73.813 1.28271 56.9 2.7 2.6 6.0
147 2 8 1 37.206 74.411 1.27387 49.8 2.4 2.3 6.0
148 1 8 4 37.241 74.482 1.27284 58.5 2.8 2.7 6.0
149 3 2 7 37.347 74.693 1.26975 115.1 5.6 5.2 6.0
150 2 6 6 37.506 75.013 1.26514 42.4 2.0 1.9 6.0
151 3 5 5 37.621 75.242 1.26186 41.0 2.0 1.9 6.0
152 3 4 6 37.662 75.324 1.26068 105.5 5.1 4.8 6.0
153 4 2 4 37.708 75.416 1.25937 51.9 2.5 2.4 6.0
154 0 4 9 37.768 75.536 1.25768 52.2 2.5 2.4 6.0
155 2 8 2 37.871 75.743 1.25475 23.3 1.1 1.1 6.0
156 0 9 2 38.013 76.026 1.25078 64.5 3.1 2.9 6.0
157 2 1 9 38.158 76.315 1.24676 143.6 6.9 6.5 6.0
158 4 4 2 38.243 76.486 1.2444 24.4 1.2 1.1 6.0
159 2 4 8 38.384 76.767 1.24054 28.6 1.4 1.3 6.0
160 1 9 1 38.442 76.885 1.23894 49.1 2.4 2.2 6.0
161 2 7 5 38.528 77.055 1.23662 50.5 2.4 2.3 6.0
162 0 2 10 38.778 77.555 1.22989 23.5 1.1 1.1 6.0
163 1 4 9 38.858 77.716 1.22774 120.4 5.8 5.4 6.0
164 4 1 5 38.897 77.795 1.2267 21.2 1.0 1.0 6.0
165 1 9 2 39.101 78.202 1.22132 89.1 4.3 4.0 6.0
166 0 7 7 39.451 78.903 1.21223 67.5 3.3 3.0 6.0
167 4 2 5 39.686 79.372 1.20624 29.2 1.4 1.3 6.0
168 3 1 8 39.853 79.707 1.20201 93.5 4.5 4.2 6.0
169 3 5 6 40.036 80.073 1.19744 29.0 1.4 1.3 6.0
170 1 7 7 40.529 81.057 1.18536 97.6 4.7 4.4 6.1
171 4 5 2 40.607 81.215 1.18346 148.5 7.2 6.7 6.1
172 0 9 4 40.638 81.277 1.18271 29.1 1.4 1.3 6.1
173 2 5 8 40.746 81.491 1.18014 40.1 1.9 1.8 6.1
174 2 7 6 40.928 81.855 1.17581 81.2 3.9 3.6 6.1
175 4 3 5 40.992 81.984 1.17429 31.8 1.5 1.4 6.1
176 1 5 9 41.213 82.427 1.1691 36.3 1.8 1.6 6.1
177 4 1 6 41.292 82.584 1.16727 29.9 1.4 1.3 6.1
178 2 9 0 41.458 82.917 1.16343 39.7 1.9 1.8 6.1
179 4 5 3 41.69 83.379 1.15815 49.1 2.4 2.2 6.1
180 2 8 5 42.444 84.889 1.14137 39.5 1.9 1.8 6.1
181 3 8 1 42.603 85.205 1.13794 69.7 3.4 3.1 6.1
182 4 6 1 42.814 85.627 1.1334 104.3 5.0 4.6 6.1
183 1 4 10 42.978 85.956 1.12991 39.6 1.9 1.8 6.1
184 2 2 10 43.068 86.137 1.12801 36.7 1.8 1.6 6.1
185 3 8 2 43.248 86.495 1.12425 31.1 1.5 1.4 6.1
186 0 2 11 43.329 86.658 1.12256 31.0 1.5 1.4 6.1
187 4 3 6 43.363 86.726 1.12185 22.7 1.1 1.0 6.1
188 2 9 3 43.397 86.793 1.12115 44.9 2.2 2.0 6.1
189 4 6 2 43.458 86.917 1.11987 39.4 1.9 1.7 6.1
190 1 1 11 43.617 87.234 1.11662 98.1 4.7 4.3 6.2
191 3 4 8 43.746 87.492 1.11399 113.7 5.5 5.0 6.2
192 3 7 5 43.886 87.773 1.11115 69.2 3.3 3.1 6.2
193 5 1 2 43.987 87.975 1.10912 21.3 1.0 0.9 6.2
194 5 2 1 44.117 88.234 1.10652 38.8 1.9 1.7 6.2
195 3 8 3 44.321 88.642 1.10249 46.1 2.2 2.0 6.2
196 1 2 11 44.39 88.781 1.10112 44.2 2.1 1.9 6.2
197 4 6 3 44.531 89.063 1.09836 68.5 3.3 3.0 6.2
198 5 0 3 44.802 89.604 1.09312 38.1 1.8 1.7 6.2
199 2 9 4 44.898 89.797 1.09128 76.5 3.7 3.4 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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