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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ALBITE
27, f-feldspar, sf-Na-K-feldspar
Na[AlSi(3)O(8)]
Triclinic C 1(-) Z = 4
C1(-)
9 .11 .11
Ref.Str.:
Gualtieri A.F. (2000)
* J. Appl. Cryst., 33, 267-278
R: from Baveno, Novara, Italy. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 8.1459 alpha = 94.25
b = 12.7973 beta = 116.6
c = 7.1578 gamma = 87.8
Unit cell volume (cub. angs.) = 665.34
Molar volume ( cub.cm/mol.) = 100.19
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.2791 0.9874 0.1794 0.0 Na = 0.98, Ca = 0.02
2 0.0132 0.1657 0.2113 0.0 Si = 0.75, Al = 0.25
3 0.01 0.8203 0.2404 0.0 Si = 0.75, Al = 0.25
4 0.6857 0.111 0.3161 0.0 Si = 0.75, Al = 0.25
5 0.6802 0.8844 0.3598 0.0 Si = 0.75, Al = 0.25
6 0.9956 0.1354 0.963 0.0 O = 1.00
7 0.5848 0.9947 0.2563 0.0 O = 1.00
8 0.8188 0.1101 0.2014 0.0 O = 1.00
9 0.8166 0.8449 0.2552 0.0 O = 1.00
10 0.0112 0.6905 0.2209 0.0 O = 1.00
11 0.2043 0.1111 0.3856 0.0 O = 1.00
12 0.1862 0.8702 0.4297 0.0 O = 1.00
13 0.0069 0.3008 0.2619 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.2791 0.9874 0.1794
2 2 0.0132 0.1657 0.2113
3 3 0.01 0.8203 0.2404
4 4 0.6857 0.111 0.3161
5 5 0.6802 0.8844 0.3598
6 6 0.9956 0.1354 0.963
7 7 0.5848 0.9947 0.2563
8 8 0.8188 0.1101 0.2014
9 9 0.8166 0.8449 0.2552
10 10 0.0112 0.6905 0.2209
11 11 0.2043 0.1111 0.3856
12 12 0.1862 0.8702 0.4297
13 13 0.0069 0.3008 0.2619
14 1 0.7209 0.0126 0.8206
15 2 0.9868 0.8343 0.7887
16 3 0.99 0.1797 0.7596
17 4 0.3143 0.889 0.6839
18 5 0.3198 0.1156 0.6402
19 6 0.0044 0.8646 0.037
20 7 0.4152 0.0053 0.7437
21 8 0.1812 0.8899 0.7986
22 9 0.1834 0.1551 0.7448
23 10 0.9888 0.3095 0.7791
24 11 0.7957 0.8889 0.6144
25 12 0.8138 0.1298 0.5703
26 13 0.9931 0.6992 0.7381
27 1 0.2209 0.5126 0.8206
28 2 0.4868 0.3343 0.7887
29 3 0.49 0.6797 0.7596
30 4 0.8143 0.389 0.6839
31 5 0.8198 0.6156 0.6402
32 6 0.5044 0.3646 0.037
33 7 0.9152 0.5053 0.7437
34 8 0.6812 0.3899 0.7986
35 9 0.6834 0.6551 0.7448
36 10 0.4888 0.8095 0.7791
37 11 0.2957 0.3889 0.6144
38 12 0.3138 0.6298 0.5703
39 13 0.4931 0.1992 0.7381
40 1 0.7791 0.4874 0.1794
41 2 0.5132 0.6657 0.2113
42 3 0.51 0.3203 0.2404
43 4 0.1857 0.611 0.3161
44 5 0.1802 0.3844 0.3598
45 6 0.4956 0.6354 0.963
46 7 0.0848 0.4947 0.2563
47 8 0.3188 0.6101 0.2014
48 9 0.3166 0.3449 0.2552
49 10 0.5112 0.1905 0.2209
50 11 0.7043 0.6111 0.3856
51 12 0.6862 0.3702 0.4297
52 13 0.5069 0.8008 0.2619
X-ray density (g/cm cub.) = 2.62
MU (1/cm) = 86.719 Mass attenuation coefficient (cm**2/g) = 33.097
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Na ,Ca 2.88 6
2.8661 6
2.3012 7
2.3326 11
2.7805 12
2.5507 6
2.6923 8
2 Si ,Al 2.316 4
1.7331 6
1.7313 8
1.6656 11
1.7436 13
3 Si ,Al 2.316 4
1.6428 9
1.6566 10
1.5826 12
1.5823 6
4 Si ,Al 2.316 4
1.6609 7
1.6262 8
1.6467 12
1.6261 10
5 Si ,Al 2.316 4
1.6432 7
1.6421 9
1.6318 11
1.6576 13
6 O 3.264 6
2.722 8
2.7623 11
2.8695 13
2.6591 9
2.6569 10
2.5199 12
7 O 3.264 6
2.6347 8
2.6408 9
2.7832 11
2.7273 12
2.5583 10
2.5923 13
8 O 3.264 6
2.722 6
2.6347 7
2.8094 11
2.8333 13
2.6522 12
2.7296 10
9 O 3.264 6
2.6408 7
2.5522 10
2.716 12
2.6591 6
2.6696 11
2.6281 13
10 O 3.264 6
2.5522 9
2.7183 12
2.6569 6
2.7485 12
2.5583 7
2.7296 8
11 O 3.264 7
2.7623 6
2.8094 8
3.1379 12
2.8296 13
2.7832 7
2.6696 9
2.7638 13
12 O 3.264 7
2.716 9
2.7183 10
3.1379 11
2.5199 6
2.7273 7
2.6522 8
2.7485 10
13 O 3.264 6
2.8695 6
2.8333 8
2.8296 11
2.7638 11
2.5923 7
2.6281 9
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 1 6.927 13.853 0.078 134.56 2 30.3 55.9
2 0 2 0 6.933 13.867 0.078 134.29 2 23.6 33.7
3 1 1 0 6.976 13.953 0.079 132.61 2 12.1 8.8
4 -1 1 0 7.012 14.024 0.079 131.25 2 13.9 11.5
5 -1 -1 1 7.488 14.975 0.085 114.82 2 16.4 14.0
6 -1 1 1 7.92 15.839 0.089 102.41 2 19.0 16.8
7 0 -2 1 9.504 19.008 0.107 70.43 2 0.1 0.0
8 0 2 1 10.136 20.271 0.114 61.67 2 9.1 2.3
9 -2 0 1 11.015 22.029 0.124 51.89 2 156.1 571.3
10 1 -1 1 11.524 23.047 0.13 47.23 2 51.4 56.3
11 1 1 1 11.77 23.54 0.132 45.18 2 87.1 154.8
12 1 3 0 12.073 24.146 0.136 42.84 2 83.4 134.5
13 -1 -3 1 12.126 24.251 0.136 42.45 2 69.1 91.5
14 -1 3 0 12.136 24.272 0.136 42.38 2 121.2 281.0
15 2 0 0 12.211 24.422 0.137 41.83 2 10.1 1.9
16 -1 -1 2 12.695 25.391 0.143 38.54 2 62.7 68.5
17 -2 -2 1 12.779 25.558 0.144 38.02 2 28.9 14.3
18 -1 3 1 12.938 25.876 0.145 37.04 2 0.4 0.0
19 -1 1 2 13.201 26.402 0.148 35.5 2 69.3 76.9
20 -2 2 1 13.339 26.678 0.15 34.72 2 9.0 1.3
21 -2 0 2 13.857 27.714 0.155 32.03 2 154.3 344.4
22 0 0 2 13.957 27.914 0.157 31.54 2 219.2 684.8
23 0 4 0 13.971 27.942 0.157 31.48 2 159.2 360.5
24 2 2 0 14.059 28.118 0.158 31.06 2 113.0 179.3
25 -2 2 0 14.132 28.263 0.158 30.72 2 124.9 216.5
26 1 -3 1 15.042 30.083 0.168 26.89 2 104.6 133.0
27 -2 -2 2 15.107 30.215 0.169 26.64 2 95.8 110.5
28 0 -2 2 15.234 30.468 0.171 26.16 2 56.5 37.7
29 0 -4 1 15.244 30.487 0.171 26.13 2 90.9 97.6
30 1 3 1 15.615 31.231 0.175 24.81 2 93.7 98.5
31 -1 -3 2 15.74 31.48 0.176 24.39 2 42.9 20.3
32 -2 2 2 15.996 31.991 0.179 23.55 2 25.7 7.1
33 0 2 2 16.051 32.103 0.179 23.38 2 3.0 0.1
34 0 4 1 16.06 32.121 0.18 23.35 2 27.4 7.9
35 2 0 1 16.646 33.292 0.186 21.61 2 18.3 3.3
36 -3 -1 1 16.799 33.598 0.188 21.18 2 19.2 3.5
37 -1 3 2 16.966 33.932 0.189 20.73 2 83.1 64.7
38 -3 1 1 17.036 34.072 0.19 20.55 2 8.7 0.7
39 -2 -4 1 17.506 35.013 0.195 19.36 2 124.2 134.9
40 -3 -1 2 17.664 35.327 0.197 18.99 2 50.6 21.9
41 1 -1 2 17.854 35.709 0.199 18.55 2 24.5 5.0
42 2 -2 1 17.96 35.919 0.2 18.31 2 28.8 6.9
43 -3 1 2 18.071 36.143 0.201 18.06 2 33.6 9.2
44 1 1 2 18.2 36.401 0.203 17.78 2 10.4 0.9
45 2 2 1 18.261 36.521 0.203 17.65 2 31.6 8.0
46 -2 4 1 18.349 36.697 0.204 17.47 2 113.0 100.8
47 -1 -5 1 18.474 36.948 0.206 17.21 2 72.2 40.5
48 1 5 0 18.614 37.228 0.207 16.92 2 2.3 0.0
49 2 4 0 18.665 37.331 0.208 16.82 2 55.1 23.1
50 -1 5 0 18.685 37.37 0.208 16.78 2 38.4 11.2
51 -2 4 0 18.778 37.557 0.209 16.6 2 36.6 10.0
52 3 1 0 18.821 37.642 0.209 16.52 2 54.8 22.4
53 -3 1 0 18.863 37.726 0.21 16.43 2 52.1 20.2
54 -2 0 3 19.121 38.243 0.213 15.95 2 5.8 0.2
55 -2 -4 2 19.152 38.305 0.213 15.89 2 22.7 3.7
56 -1 -1 3 19.251 38.501 0.214 15.71 2 2.8 0.1
57 0 -4 2 19.283 38.566 0.214 15.65 2 29.7 6.2
58 -3 -3 1 19.404 38.807 0.216 15.44 2 106.4 78.9
59 -1 5 1 19.408 38.816 0.216 15.43 2 34.0 8.1
60 -1 1 3 19.77 39.54 0.22 14.81 2 38.6 10.0
61 -2 -2 3 19.914 39.828 0.221 14.57 2 20.7 2.8
62 -3 -3 2 20.007 40.014 0.222 14.42 2 6.3 0.3
63 -3 3 1 20.027 40.054 0.222 14.39 2 63.5 26.2
64 1 -3 2 20.232 40.464 0.224 14.07 2 47.7 14.4
65 -2 4 2 20.588 41.176 0.228 13.53 2 59.0 21.3
66 0 4 2 20.607 41.214 0.228 13.51 2 37.2 8.4
67 1 -5 1 20.613 41.225 0.229 13.5 2 77.1 36.3
68 -2 2 3 20.94 41.88 0.232 13.03 2 44.1 11.4
69 -1 -5 2 20.965 41.931 0.232 12.99 2 22.0 2.8
70 -3 3 2 21.094 42.187 0.234 12.82 2 34.3 6.8
71 -3 -1 3 21.108 42.217 0.234 12.8 2 28.3 4.6
72 1 3 2 21.156 42.312 0.234 12.73 2 0.6 0.0
73 0 0 3 21.21 42.421 0.235 12.66 2 8.8 0.4
74 0 6 0 21.232 42.464 0.235 12.63 2 115.2 75.8
75 -1 -3 3 21.316 42.632 0.236 12.52 2 40.2 9.1
76 1 5 1 21.342 42.684 0.236 12.49 2 85.5 41.3
77 3 3 0 21.369 42.739 0.237 12.45 2 33.4 6.3
78 -3 3 0 21.483 42.966 0.238 12.3 2 13.5 1.0
79 -3 1 3 21.616 43.231 0.239 12.13 2 54.4 16.2
80 2 -4 1 21.744 43.488 0.24 11.97 2 66.7 24.0
81 0 -2 3 21.965 43.931 0.243 11.7 2 33.1 5.8
82 0 -6 1 21.984 43.968 0.243 11.68 2 0.6 0.0
83 2 4 1 22.256 44.512 0.246 11.36 2 39.3 7.9
84 -4 0 2 22.465 44.93 0.248 11.13 2 47.1 11.1
85 -1 5 2 22.569 45.137 0.249 11.01 2 28.1 3.9
86 -4 0 1 22.621 45.241 0.25 10.95 2 62.5 19.3
87 2 0 2 22.663 45.327 0.25 10.91 2 37.0 6.8
88 -1 3 3 22.727 45.454 0.251 10.84 2 32.2 5.1
89 0 2 3 22.868 45.737 0.252 10.69 2 29.1 4.1
90 0 6 1 22.887 45.773 0.252 10.67 2 93.2 41.8
91 3 -1 1 22.971 45.943 0.253 10.58 2 39.9 7.6
92 -3 -3 3 23.013 46.026 0.254 10.54 2 4.4 0.1
93 3 1 1 23.083 46.166 0.254 10.46 2 34.8 5.7
94 -2 -4 3 23.096 46.192 0.255 10.45 2 0.1 0.0
95 -4 -2 2 23.286 46.573 0.257 10.26 2 44.2 9.1
96 2 -2 2 23.55 47.099 0.259 10.0 2 76.5 26.5
97 -4 -2 1 23.583 47.166 0.26 9.97 2 14.0 0.9
98 -2 -6 1 23.672 47.343 0.261 9.88 2 2.3 0.0
99 -4 2 2 23.958 47.917 0.264 9.62 2 115.6 58.1
100 -4 2 1 23.964 47.927 0.264 9.61 2 7.2 0.2
101 -3 -5 1 24.071 48.142 0.265 9.52 2 51.0 11.2
102 2 2 2 24.078 48.155 0.265 9.51 2 110.4 52.4
103 -3 3 3 24.415 48.83 0.268 9.21 2 20.0 1.7
104 -3 -5 2 24.441 48.882 0.269 9.19 2 10.3 0.4
105 -4 0 3 24.592 49.184 0.27 9.06 2 152.3 95.0
106 -2 6 1 24.662 49.324 0.271 9.0 2 20.7 1.7
107 1 -5 2 24.678 49.357 0.271 8.99 2 7.5 0.2
108 2 6 0 24.728 49.456 0.272 8.95 2 78.6 25.0
109 -2 -6 2 24.842 49.683 0.273 8.86 2 31.6 4.0
110 -2 6 0 24.864 49.727 0.273 8.84 2 107.5 46.2
111 1 -1 3 24.894 49.787 0.273 8.82 2 34.6 4.8
112 -2 4 3 24.902 49.805 0.273 8.81 2 19.8 1.6
113 -3 5 1 24.945 49.89 0.274 8.77 2 5.0 0.1
114 0 -4 3 24.96 49.92 0.274 8.76 2 101.0 40.4
115 0 -6 2 24.971 49.941 0.274 8.75 2 114.7 52.0
116 4 0 0 25.026 50.051 0.275 8.71 2 126.3 62.8
117 3 -3 1 25.108 50.216 0.275 8.64 2 47.7 8.9
118 -4 -2 3 25.223 50.446 0.277 8.56 2 33.0 4.2
119 1 1 3 25.297 50.594 0.277 8.5 2 82.5 26.1
120 3 3 1 25.42 50.84 0.279 8.41 2 49.6 9.3
121 -1 -5 3 25.455 50.909 0.279 8.38 2 9.7 0.4
122 -1 -7 1 25.537 51.074 0.28 8.32 2 9.2 0.3
123 -2 0 4 25.573 51.146 0.28 8.29 2 167.8 105.4
124 1 7 0 25.781 51.562 0.282 8.14 2 37.7 5.2
125 -1 7 0 25.858 51.716 0.283 8.08 2 47.4 8.2
126 3 5 0 25.886 51.773 0.283 8.06 2 21.9 1.8
127 -3 5 2 25.985 51.97 0.284 7.99 2 23.2 2.0
128 1 5 2 25.995 51.99 0.284 7.99 2 31.2 3.5
129 -3 5 0 26.05 52.1 0.285 7.95 2 6.0 0.1
130 4 2 0 26.055 52.109 0.285 7.95 2 53.3 10.2
131 -2 -2 4 26.074 52.149 0.285 7.93 2 86.3 26.7
132 -4 2 3 26.126 52.253 0.286 7.9 2 47.0 7.9
133 -4 2 0 26.142 52.283 0.286 7.89 2 51.3 9.4
134 -4 -4 2 26.256 52.511 0.287 7.81 2 112.1 44.3
135 -3 -1 4 26.307 52.614 0.288 7.77 2 24.5 2.1
136 -1 -1 4 26.436 52.871 0.289 7.69 2 49.5 8.5
137 -1 7 1 26.555 53.109 0.29 7.61 2 34.3 4.1
138 2 -4 2 26.561 53.123 0.29 7.61 2 66.4 15.2
139 0 4 3 26.586 53.172 0.291 7.59 2 55.2 10.4
140 0 6 2 26.596 53.193 0.291 7.58 2 81.0 22.5
141 -2 6 2 26.602 53.205 0.291 7.58 2 58.7 11.8
142 1 -3 3 26.631 53.262 0.291 7.56 2 79.0 21.3
143 -4 -4 1 26.66 53.319 0.291 7.54 2 57.2 11.2
144 -3 1 4 26.87 53.739 0.293 7.41 2 25.1 2.1
145 -3 -5 3 26.93 53.86 0.294 7.37 2 35.1 4.1
146 -1 1 4 26.975 53.95 0.294 7.34 2 44.1 6.5
147 2 -6 1 27.173 54.345 0.296 7.22 2 1.9 0.0
148 -2 2 4 27.177 54.354 0.296 7.22 2 70.8 16.3
149 1 -7 1 27.251 54.503 0.297 7.17 2 17.9 1.0
150 -4 4 1 27.354 54.709 0.298 7.11 2 57.4 10.6
151 -1 -7 2 27.387 54.774 0.299 7.09 2 49.6 7.9
152 -4 4 2 27.479 54.958 0.3 7.04 2 69.4 15.3
153 -1 5 3 27.503 55.006 0.3 7.03 2 10.6 0.4
154 2 4 2 27.525 55.049 0.3 7.01 2 76.9 18.8
155 1 3 3 27.774 55.548 0.302 6.87 2 44.1 6.0
156 -3 -3 4 27.813 55.625 0.303 6.85 2 0.4 0.0
157 2 6 1 27.824 55.648 0.303 6.84 2 6.0 0.1
158 -4 -4 3 27.914 55.828 0.304 6.79 2 11.8 0.4
159 -1 -3 4 27.957 55.914 0.304 6.77 2 52.8 8.5
160 -2 -6 3 28.033 56.066 0.305 6.73 2 27.9 2.4
161 1 7 1 28.081 56.163 0.306 6.7 2 26.5 2.1
162 -5 -1 2 28.338 56.676 0.308 6.56 2 0.7 0.0
163 3 -1 2 28.602 57.205 0.311 6.43 2 21.2 1.3
164 -2 -4 4 28.604 57.208 0.311 6.43 2 11.8 0.4
165 -4 0 4 28.62 57.239 0.311 6.42 2 3.2 0.0
166 -5 1 2 28.642 57.285 0.311 6.41 2 7.1 0.1
167 3 1 2 28.824 57.647 0.313 6.32 2 5.5 0.1
168 0 0 4 28.842 57.683 0.313 6.31 2 66.4 12.6
169 0 8 0 28.872 57.745 0.313 6.29 2 71.5 14.5
170 -3 5 3 29.007 58.015 0.315 6.23 2 81.2 18.5
171 -4 -2 4 29.065 58.129 0.315 6.2 2 88.9 22.1
172 4 4 0 29.067 58.135 0.315 6.2 2 11.5 0.4
173 3 -5 1 29.128 58.256 0.316 6.17 2 50.0 7.0
174 -4 4 0 29.229 58.458 0.317 6.12 2 19.5 1.1
175 -1 7 2 29.239 58.477 0.317 6.12 2 14.4 0.6
176 4 0 1 29.27 58.54 0.317 6.1 2 19.5 1.0
177 -5 -1 1 29.304 58.608 0.318 6.09 2 49.4 6.7
178 0 -2 4 29.325 58.65 0.318 6.08 2 73.2 14.7
179 -5 -1 3 29.345 58.69 0.318 6.07 2 4.8 0.1
180 0 -8 1 29.353 58.707 0.318 6.06 2 73.5 14.8
181 -3 3 4 29.419 58.838 0.319 6.03 2 9.8 0.3
182 -5 1 1 29.478 58.956 0.319 6.01 2 65.8 11.8
183 -1 3 4 29.498 58.997 0.32 6.0 2 56.7 8.7
184 -4 4 3 29.587 59.174 0.32 5.96 2 28.6 2.2
185 3 5 1 29.598 59.196 0.321 5.95 2 75.0 15.1
186 2 0 3 29.599 59.198 0.321 5.95 2 50.8 6.9
187 0 -6 3 29.693 59.386 0.322 5.91 2 6.7 0.1
188 -5 1 3 29.766 59.532 0.322 5.88 2 60.4 9.7
189 -5 -3 2 30.0 60.001 0.325 5.77 2 46.9 5.7
190 -3 -7 1 30.098 60.197 0.326 5.73 2 12.4 0.4
191 -4 2 4 30.133 60.266 0.326 5.72 2 73.0 13.8
192 4 -2 1 30.156 60.313 0.326 5.71 2 3.5 0.0
193 2 -2 3 30.217 60.433 0.327 5.68 2 59.9 9.2
194 1 -5 3 30.251 60.502 0.327 5.67 2 31.5 2.5
195 -3 -7 2 30.295 60.59 0.327 5.65 2 43.7 4.9
196 0 2 4 30.309 60.618 0.328 5.64 2 31.2 2.5
197 4 2 1 30.321 60.643 0.328 5.64 2 1.9 0.0
198 3 -3 2 30.334 60.669 0.328 5.63 2 21.3 1.2
199 0 8 1 30.337 60.673 0.328 5.63 2 6.4 0.1
200 -2 6 3 30.397 60.793 0.328 5.61 2 30.7 2.4
201 1 -7 2 30.54 61.08 0.33 5.55 2 40.0 4.0
202 -2 4 4 30.66 61.319 0.331 5.5 2 77.0 14.8
203 -2 -8 1 30.726 61.451 0.332 5.47 2 108.7 29.2
204 -5 -3 3 30.853 61.706 0.333 5.42 2 100.9 25.0
205 -5 3 2 30.877 61.754 0.333 5.41 2 23.4 1.3
206 2 2 3 30.904 61.809 0.333 5.4 2 22.7 1.3
207 -4 -6 2 30.934 61.869 0.334 5.39 2 62.7 9.6
208 3 3 2 30.972 61.944 0.334 5.38 2 49.0 5.8
209 -5 -3 1 31.054 62.108 0.335 5.35 2 50.1 6.1
210 -1 -7 3 31.077 62.154 0.335 5.34 2 28.3 1.9
211 -3 7 1 31.152 62.303 0.336 5.31 2 1.2 0.0
212 -3 -5 4 31.185 62.371 0.336 5.3 2 50.8 6.2
213 2 -6 2 31.268 62.536 0.337 5.27 2 41.6 4.1
214 -1 -5 4 31.339 62.679 0.338 5.24 2 14.3 0.5
215 -4 -4 4 31.416 62.833 0.338 5.21 2 20.7 1.0
216 -4 -6 1 31.418 62.836 0.338 5.21 2 69.7 11.4
217 -5 3 1 31.558 63.115 0.34 5.16 2 74.3 12.9
218 -2 -8 2 31.596 63.191 0.34 5.15 2 60.4 8.5
219 0 -4 4 31.703 63.407 0.341 5.11 2 63.4 9.3
220 0 -8 2 31.725 63.45 0.341 5.1 2 33.6 2.6
221 2 8 0 31.736 63.473 0.341 5.1 2 143.7 47.6
222 3 7 0 31.794 63.588 0.342 5.08 2 36.9 3.1
223 -2 8 1 31.837 63.675 0.342 5.06 2 9.8 0.2
224 0 6 3 31.866 63.732 0.343 5.05 2 129.5 38.3
225 -2 8 0 31.89 63.78 0.343 5.04 2 118.8 32.2
226 -3 7 0 31.995 63.991 0.344 5.01 2 59.4 8.0
227 1 5 3 32.001 64.003 0.344 5.01 2 34.4 2.7
228 -5 3 3 32.071 64.141 0.345 4.98 2 71.5 11.5
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231 -3 7 2 32.174 64.349 0.346 4.95 2 29.1 1.9
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233 -5 -1 4 32.209 64.419 0.346 4.94 2 19.5 0.9
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235 -4 6 1 32.358 64.716 0.347 4.89 2 134.9 40.2
236 -3 -7 3 32.364 64.728 0.347 4.88 2 43.2 4.1
237 1 -1 4 32.548 65.097 0.349 4.83 2 47.3 4.9
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239 -4 6 2 32.588 65.175 0.35 4.81 2 96.9 20.4
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243 -2 -6 4 32.857 65.714 0.352 4.73 2 55.9 6.7
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247 -2 -2 5 33.177 66.354 0.355 4.63 2 21.6 1.0
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249 -1 -9 1 33.237 66.474 0.356 4.61 2 4.2 0.0
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252 -5 -5 2 33.45 66.901 0.358 4.55 2 2.9 0.0
253 -5 -3 4 33.528 67.057 0.359 4.53 2 108.3 24.0
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260 -3 5 4 33.673 67.346 0.36 4.49 2 7.5 0.1
261 4 6 0 33.728 67.455 0.36 4.47 2 104.7 22.1
262 -1 5 4 33.728 67.456 0.36 4.47 2 20.6 0.9
263 2 -8 1 33.771 67.543 0.361 4.46 2 64.2 8.3
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267 -3 -3 5 33.935 67.87 0.362 4.42 2 22.1 1.0
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271 -4 0 5 34.128 68.257 0.364 4.36 2 135.6 36.3
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277 -4 -2 5 34.418 68.837 0.367 4.29 2 97.5 18.4
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283 -1 -9 2 34.715 69.43 0.37 4.21 2 129.9 32.1
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286 -1 1 5 34.829 69.658 0.371 4.19 2 85.2 13.7
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292 3 7 1 35.231 70.462 0.374 4.09 2 35.5 2.3
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313 -3 -7 4 36.133 72.266 0.383 3.89 2 28.1 1.4
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315 -6 2 3 36.245 72.49 0.384 3.87 2 84.5 12.5
316 -1 -7 4 36.294 72.589 0.384 3.86 2 49.6 4.3
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319 -5 -5 4 36.584 73.168 0.387 3.8 2 10.3 0.2
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321 -5 -1 5 36.698 73.397 0.388 3.78 2 39.7 2.7
322 -1 9 2 36.811 73.622 0.389 3.76 2 94.9 15.3
323 3 -3 3 36.821 73.642 0.389 3.75 2 97.9 16.3
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325 -3 -5 5 36.883 73.767 0.39 3.74 2 61.7 6.4
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328 -6 0 4 36.99 73.98 0.391 3.72 2 66.4 7.4
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330 0 0 5 37.084 74.169 0.391 3.7 2 75.3 9.5
331 -2 8 3 37.101 74.202 0.392 3.7 2 51.0 4.3
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340 -6 -2 4 37.363 74.725 0.394 3.65 2 49.1 4.0
341 2 0 4 37.379 74.758 0.394 3.65 2 72.3 8.6
342 5 5 0 37.394 74.788 0.394 3.65 2 24.6 1.0
343 0 -2 5 37.4 74.8 0.394 3.65 2 43.4 3.1
344 0 -10 1 37.44 74.881 0.395 3.64 2 37.1 2.3
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355 -5 -3 5 37.836 75.672 0.398 3.57 2 105.0 17.8
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367 -5 -7 2 38.458 76.917 0.404 3.47 2 8.3 0.1
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380 2 8 2 38.953 77.905 0.408 3.4 2 142.0 30.9
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382 -5 -7 3 39.004 78.008 0.409 3.39 2 19.0 0.6
383 -4 8 2 39.02 78.04 0.409 3.39 2 145.5 32.4
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393 1 9 2 39.419 78.839 0.412 3.33 2 41.6 2.6
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431 -2 -2 6 41.254 82.509 0.428 3.11 2 9.4 0.1
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434 3 5 3 41.432 82.864 0.43 3.09 2 113.0 17.8
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468 -4 2 6 42.446 84.893 0.438 3.0 2 27.0 1.0
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470 2 -8 3 42.481 84.962 0.438 3.0 2 50.1 3.4
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477 -1 -9 4 42.671 85.343 0.44 2.98 2 112.4 17.0
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481 -7 -3 3 42.858 85.716 0.442 2.97 2 39.2 2.1
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490 -2 -4 6 43.115 86.229 0.444 2.95 2 44.2 2.6
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515 -1 -3 6 43.987 87.974 0.451 2.89 2 86.8 9.8
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517 -7 -1 1 44.143 88.287 0.452 2.88 2 11.2 0.2
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519 -7 3 2 44.237 88.475 0.453 2.87 2 16.0 0.3
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521 -7 1 1 44.31 88.619 0.453 2.87 2 9.2 0.1
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525 -2 -8 5 44.39 88.781 0.454 2.86 2 77.9 7.9
526 -5 7 4 44.519 89.038 0.455 2.85 2 11.6 0.2
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528 1 7 4 44.619 89.238 0.456 2.85 2 13.3 0.2
529 -4 8 4 44.692 89.384 0.457 2.84 2 73.0 6.8
530 3 -7 3 44.696 89.391 0.457 2.84 2 17.1 0.4
531 4 -4 3 44.707 89.414 0.457 2.84 2 39.5 2.0
532 0 8 4 44.741 89.483 0.457 2.84 2 55.0 3.9
533 1 9 3 44.751 89.502 0.457 2.84 2 4.3 0.0
534 2 -10 2 44.757 89.513 0.457 2.84 2 16.5 0.3
535 2 8 3 44.893 89.787 0.458 2.83 2 37.9 1.8
536 -5 -9 2 44.939 89.878 0.459 2.83 2 59.7 4.6
537 6 -2 1 44.95 89.901 0.459 2.83 2 16.0 0.3
538 -4 -10 1 44.999 89.998 0.459 2.83 2 13.3 0.2
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 1 6.927 13.853 6.38717 89.6 8.6 8.7 5.6
2 -1 1 0 7.012 14.024 6.30986 11.5 1.1 1.1 5.6
3 -1 -1 1 7.488 14.975 5.91097 14.0 1.3 1.3 5.6
4 -1 1 1 7.92 15.839 5.59058 16.8 1.6 1.6 5.6
5 -2 0 1 11.015 22.029 4.0316 571.3 54.7 54.9 5.6
6 1 -1 1 11.524 23.047 3.8558 56.3 5.4 5.4 5.6
7 1 1 1 11.77 23.54 3.77612 154.8 14.8 14.9 5.6
8 1 3 0 12.073 24.146 3.6828 134.5 12.9 12.9 5.6
9 -1 3 0 12.136 24.272 3.66398 372.6 35.6 35.7 5.6
10 -1 -1 2 12.695 25.391 3.50494 68.5 6.6 6.6 5.6
11 -2 -2 1 12.779 25.558 3.48247 14.3 1.4 1.4 5.6
12 -1 1 2 13.201 26.402 3.37295 76.9 7.4 7.4 5.6
13 -2 0 2 13.857 27.714 3.21624 344.4 32.9 33.0 5.6
14 0 0 2 13.957 27.914 3.19359 1045.3 100.0 100.0 5.6
15 2 2 0 14.059 28.118 3.17094 179.3 17.2 17.2 5.6
16 -2 2 0 14.132 28.263 3.15493 216.5 20.7 20.7 5.6
17 1 -3 1 15.042 30.083 2.96808 133.0 12.7 12.7 5.6
18 -2 -2 2 15.107 30.215 2.95549 110.5 10.6 10.6 5.6
19 0 -4 1 15.244 30.487 2.92969 135.3 12.9 12.9 5.6
20 1 3 1 15.615 31.231 2.8616 98.5 9.4 9.4 5.6
21 -1 -3 2 15.74 31.48 2.83951 20.3 1.9 1.9 5.6
22 -1 3 2 16.966 33.932 2.63969 64.7 6.2 6.2 5.7
23 -2 -4 1 17.506 35.013 2.56067 134.9 12.9 12.8 5.7
24 -3 -1 2 17.664 35.327 2.53858 21.9 2.1 2.1 5.7
25 -2 4 1 18.349 36.697 2.44691 100.8 9.6 9.6 5.7
26 -1 -5 1 18.474 36.948 2.43086 40.5 3.9 3.8 5.7
27 2 4 0 18.665 37.331 2.40683 34.3 3.3 3.2 5.7
28 3 1 0 18.821 37.642 2.38765 22.4 2.1 2.1 5.7
29 -3 1 0 18.863 37.726 2.3825 20.2 1.9 1.9 5.7
30 -3 -3 1 19.404 38.807 2.31857 87.0 8.3 8.2 5.7
31 -3 3 1 20.027 40.054 2.24926 26.2 2.5 2.5 5.7
32 1 -3 2 20.232 40.464 2.22739 14.4 1.4 1.4 5.7
33 1 -5 1 20.613 41.225 2.188 66.0 6.3 6.2 5.7
34 -2 2 3 20.94 41.88 2.15528 14.3 1.4 1.3 5.7
35 -3 3 2 21.094 42.187 2.14031 11.5 1.1 1.1 5.7
36 0 6 0 21.232 42.464 2.127 75.8 7.2 7.2 5.7
37 1 5 1 21.342 42.684 2.11654 56.7 5.4 5.3 5.7
38 -3 1 3 21.616 43.231 2.091 16.2 1.6 1.5 5.7
39 2 -4 1 21.744 43.488 2.07923 24.0 2.3 2.3 5.7
40 -4 0 2 22.465 44.93 2.0158 11.1 1.1 1.0 5.7
41 -4 0 1 22.621 45.241 2.00266 19.3 1.8 1.8 5.7
42 0 6 1 22.887 45.773 1.98063 45.9 4.4 4.3 5.7
43 2 -2 2 23.55 47.099 1.9279 26.5 2.5 2.5 5.7
44 -4 2 2 23.958 47.917 1.89691 58.3 5.6 5.5 5.7
45 2 2 2 24.078 48.155 1.88806 63.5 6.1 6.0 5.7
46 -4 0 3 24.592 49.184 1.85096 95.0 9.1 8.9 5.7
47 2 6 0 24.728 49.456 1.8414 25.0 2.4 2.3 5.7
48 -2 6 0 24.864 49.727 1.83199 50.1 4.8 4.7 5.7
49 0 -6 2 24.971 49.941 1.82465 92.4 8.8 8.6 5.7
50 4 0 0 25.026 50.051 1.82089 62.8 6.0 5.9 5.7
51 1 1 3 25.297 50.594 1.80264 26.1 2.5 2.4 5.8
52 -2 0 4 25.573 51.146 1.78446 105.4 10.1 9.9 5.8
53 -2 -2 4 26.074 52.149 1.75247 36.9 3.5 3.4 5.8
54 -4 2 0 26.142 52.283 1.74828 17.3 1.7 1.6 5.8
55 -4 -4 2 26.256 52.511 1.74124 44.3 4.2 4.1 5.8
56 2 -4 2 26.561 53.123 1.72262 19.2 1.8 1.8 5.8
57 -2 6 2 26.602 53.205 1.72016 77.1 7.4 7.2 5.8
58 -2 2 4 27.177 54.354 1.68647 16.3 1.6 1.5 5.8
59 -4 4 1 27.354 54.709 1.67637 10.6 1.0 1.0 5.8
60 -4 4 2 27.479 54.958 1.66934 15.7 1.5 1.5 5.8
61 2 4 2 27.525 55.049 1.66681 18.8 1.8 1.7 5.8
62 0 0 4 28.842 57.683 1.59679 12.6 1.2 1.2 5.8
63 0 8 0 28.872 57.745 1.59525 14.5 1.4 1.3 5.8
64 -3 5 3 29.007 58.015 1.58846 18.5 1.8 1.7 5.8
65 -4 -2 4 29.065 58.129 1.5856 22.5 2.2 2.1 5.8
66 0 -2 4 29.325 58.65 1.57277 36.2 3.5 3.3 5.8
67 -5 1 1 29.478 58.956 1.56532 20.5 2.0 1.9 5.8
68 2 0 3 29.599 59.198 1.5595 24.3 2.3 2.2 5.8
69 -4 2 4 30.133 60.266 1.53439 13.8 1.3 1.3 5.8
70 -2 4 4 30.66 61.319 1.51054 14.8 1.4 1.4 5.8
71 -2 -8 1 30.726 61.451 1.50761 29.2 2.8 2.7 5.8
72 -5 -3 3 30.853 61.706 1.502 26.3 2.5 2.4 5.8
73 -4 -6 1 31.418 62.836 1.47768 12.4 1.2 1.1 5.9
74 -5 3 1 31.558 63.115 1.47181 12.9 1.2 1.2 5.9
75 0 -4 4 31.703 63.407 1.46574 11.9 1.1 1.1 5.9
76 2 8 0 31.736 63.473 1.46437 47.6 4.5 4.4 5.9
77 0 6 3 31.866 63.732 1.45905 70.4 6.7 6.5 5.9
78 -3 7 0 31.995 63.991 1.45376 10.7 1.0 1.0 5.9
79 -5 3 3 32.071 64.141 1.45072 11.5 1.1 1.1 5.9
80 -4 -6 3 32.321 64.642 1.44069 16.7 1.6 1.5 5.9
81 -4 6 1 32.358 64.716 1.43922 44.3 4.2 4.1 5.9
82 2 6 2 32.572 65.144 1.4308 55.5 5.3 5.1 5.9
83 2 -4 3 32.692 65.385 1.4261 24.3 2.3 2.2 5.9
84 -5 1 4 32.725 65.451 1.42483 11.2 1.1 1.0 5.9
85 1 1 4 33.005 66.01 1.4141 25.8 2.5 2.4 5.9
86 4 4 1 33.201 66.402 1.40671 11.3 1.1 1.0 5.9
87 -5 -3 4 33.528 67.057 1.39455 24.0 2.3 2.2 5.9
88 1 9 0 33.56 67.119 1.3934 12.3 1.2 1.1 5.9
89 -1 9 0 33.644 67.287 1.39033 17.0 1.6 1.6 5.9
90 4 6 0 33.728 67.455 1.38728 23.0 2.2 2.1 5.9
91 1 -3 4 33.916 67.832 1.38048 34.0 3.3 3.1 5.9
92 2 4 3 34.004 68.008 1.37734 17.3 1.7 1.6 5.9
93 -4 0 5 34.128 68.257 1.37293 37.6 3.6 3.4 5.9
94 -4 -2 5 34.418 68.837 1.36277 18.4 1.8 1.7 5.9
95 -4 6 3 34.622 69.243 1.35576 12.9 1.2 1.2 5.9
96 -6 0 2 34.704 69.409 1.35293 73.8 7.1 6.7 5.9
97 -1 1 5 34.829 69.658 1.3487 14.6 1.4 1.3 5.9
98 4 0 2 34.954 69.908 1.34449 56.1 5.4 5.1 5.9
99 -6 -2 2 35.312 70.624 1.3326 14.8 1.4 1.3 5.9
100 -1 -3 5 35.457 70.914 1.32785 27.7 2.7 2.5 5.9
101 0 -6 4 35.767 71.534 1.31787 21.1 2.0 1.9 5.9
102 -6 2 3 36.245 72.49 1.30282 12.5 1.2 1.1 5.9
103 3 -3 3 36.821 73.642 1.28527 32.1 3.1 2.9 6.0
104 -4 -8 2 36.986 73.973 1.28033 35.9 3.4 3.2 6.0
105 0 0 5 37.084 74.169 1.27743 13.8 1.3 1.2 6.0
106 0 10 0 37.126 74.253 1.2762 14.8 1.4 1.3 6.0
107 4 -6 1 37.254 74.507 1.27247 12.9 1.2 1.2 6.0
108 2 -8 2 37.347 74.693 1.26976 36.5 3.5 3.3 6.0
109 2 0 4 37.379 74.758 1.26882 12.7 1.2 1.1 6.0
110 -6 -4 3 37.697 75.394 1.25969 10.9 1.0 1.0 6.0
111 -5 -3 5 37.836 75.672 1.25575 26.8 2.6 2.4 6.0
112 0 6 4 38.415 76.83 1.23969 20.3 1.9 1.8 6.0
113 -6 4 2 38.742 77.484 1.23084 11.7 1.1 1.0 6.0
114 -4 4 5 38.809 77.618 1.22905 20.8 2.0 1.9 6.0
115 2 8 2 38.953 77.905 1.22524 30.9 3.0 2.8 6.0
116 -4 8 2 39.02 78.04 1.22345 35.0 3.3 3.1 6.0
117 6 0 0 39.386 78.771 1.21392 31.3 3.0 2.8 6.0
118 3 -5 3 39.953 79.905 1.19952 15.8 1.5 1.4 6.0
119 -4 -6 5 40.184 80.368 1.19378 23.1 2.2 2.1 6.0
120 -3 1 6 40.899 81.798 1.17649 23.3 2.2 2.1 6.1
121 -2 0 6 41.072 82.144 1.17241 13.0 1.2 1.2 6.1
122 -1 5 5 41.117 82.234 1.17135 13.6 1.3 1.2 6.1
123 -3 -3 6 41.247 82.494 1.16831 17.5 1.7 1.6 6.1
124 3 5 3 41.432 82.864 1.16403 19.7 1.9 1.7 6.1
125 1 -7 4 41.701 83.402 1.1579 15.8 1.5 1.4 6.1
126 -3 9 3 42.198 84.396 1.14677 12.4 1.2 1.1 6.1
127 -2 6 5 42.377 84.753 1.14284 17.1 1.6 1.5 6.1
128 6 4 0 42.655 85.311 1.1368 35.8 3.4 3.1 6.1
129 -6 4 0 42.862 85.725 1.13236 20.3 1.9 1.8 6.1
130 -6 6 3 43.8 87.599 1.1129 14.9 1.4 1.3 6.2
131 -1 -3 6 43.987 87.974 1.10912 11.9 1.1 1.0 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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