Institute of Experimental Mineralogy
Russian Academy of Sciences
-------------------------------------------------
142432, Chernogolovka, Moscow district
A.V. Chichagov +7(496)52-22320
***
*** W W W - X R A Y P O L ***
***********************
STRANSKIITE
2
Zn(2)Cu[AsO(4)](2)
Triclinic P 1(-) Z = 1
P1(-)
26 .9 .23
Ref.Str.:
Keller P., Hess H., Dunn P.J. (1979)
* Tschermaks Mineral. Petrograph. Mitt., 26, 167-174
R: N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.092 alpha = 110.16
b = 6.695 beta = 112.09
c = 5.304 gamma = 86.74
Unit cell volume (cub. angs.) = 156.73
Molar volume ( cub.cm/mol.) = 94.4
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.2303 0.1857 0.7357 0.0 Zn = 1.00
2 0.5 0.5 0.5 0.0 Cu = 1.00
3 0.8647 0.2761 0.138 0.0 As = 1.00
4 0.1838 0.3332 0.129 0.0 O = 1.00
5 0.9082 0.1212 0.3429 0.0 O = 1.00
6 0.6336 0.1554 0.7986 0.0 O = 1.00
7 0.733 0.5045 0.2921 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.2303 0.1857 0.7357
2 2 0.5 0.5 0.5
3 3 0.8647 0.2761 0.138
4 4 0.1838 0.3332 0.129
5 5 0.9082 0.1212 0.3429
6 6 0.6336 0.1554 0.7986
7 7 0.733 0.5045 0.2921
8 1 0.7697 0.8143 0.2643
9 3 0.1353 0.7239 0.862
10 4 0.8162 0.6668 0.871
11 5 0.0918 0.8788 0.6571
12 6 0.3664 0.8446 0.2014
13 7 0.267 0.4955 0.7079
X-ray density (g/cm cub.) = 5.0
MU (1/cm) = 267.068 Mass attenuation coefficient (cm**2/g) = 53.406
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Zn 2.628 5
2.0755 4
2.0267 5
1.9631 6
2.0606 5
2.1527 7
2 Cu 2.808 4
2.0046 4
1.9067 7
2.0046 4
1.9067 7
3 As 2.46 4
1.7118 4
1.6957 5
1.6705 6
1.7001 7
4 O 3.264 8
2.7938 5
2.7542 6
2.7831 7
2.8006 7
3.1732 4
3.1258 5
2.75 7
2.9641 7
5 O 3.264 9
2.7938 4
3.1581 6
2.7794 6
2.7367 7
3.1258 4
2.6086 5
3.0502 6
3.1096 6
2.8075 7
6 O 3.264 8
2.7542 4
2.7794 5
3.1581 5
2.7371 7
3.0502 5
3.1096 5
2.9583 6
2.9149 7
7 O 3.264 10
2.8006 4
2.7831 4
2.7367 5
2.7371 6
2.75 4
2.9641 4
2.8075 5
2.9149 6
2.7971 7
3.0973 7
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 7.065 14.13 0.08 129.25 2 18.0 339.9
2 1 0 0 9.429 18.859 0.106 71.59 2 26.3 402.5
3 0 0 1 9.629 19.259 0.109 68.55 2 10.1 57.3
4 0 -1 1 9.759 19.517 0.11 66.69 2 14.6 115.8
5 -1 0 1 10.622 21.243 0.12 55.96 2 40.0 729.5
6 -1 -1 1 11.255 22.51 0.127 49.61 2 21.0 178.2
7 -1 1 0 11.33 22.66 0.128 48.92 2 25.2 252.8
8 1 1 0 12.294 24.588 0.138 41.24 2 21.1 148.8
9 0 1 1 13.873 27.745 0.156 31.95 2 11.7 35.8
10 0 -2 1 14.147 28.293 0.159 30.65 2 119.8 3581.8
11 -1 1 1 14.192 28.384 0.159 30.44 2 100.9 2525.6
12 0 2 0 14.24 28.48 0.16 30.22 2 57.8 823.5
13 -1 -2 1 15.617 31.233 0.175 24.8 2 43.8 387.8
14 1 -1 1 15.68 31.361 0.175 24.59 2 16.3 53.5
15 1 0 1 15.967 31.933 0.179 23.65 2 118.0 2682.8
16 -1 2 0 16.494 32.988 0.184 22.04 2 39.1 274.0
17 -1 -1 2 17.136 34.272 0.191 20.29 2 90.9 1365.7
18 -2 0 1 17.82 35.639 0.199 18.62 2 89.3 1209.1
19 1 2 0 17.863 35.726 0.199 18.53 2 80.1 968.5
20 -1 0 2 18.154 36.307 0.202 17.88 2 33.7 165.8
21 0 -1 2 18.272 36.543 0.204 17.63 2 15.9 36.5
22 1 -2 1 18.5 37.0 0.206 17.15 2 38.1 202.7
23 -2 -1 1 18.543 37.087 0.206 17.07 2 62.8 548.0
24 -1 -2 2 19.076 38.151 0.212 16.03 2 18.6 45.0
25 2 0 0 19.127 38.254 0.213 15.94 2 41.2 220.3
26 1 1 1 19.236 38.472 0.214 15.74 2 40.4 208.7
27 0 0 2 19.545 39.091 0.217 15.19 2 51.3 326.1
28 0 -2 2 19.816 39.632 0.22 14.74 2 19.5 45.5
29 -2 1 0 19.89 39.78 0.221 14.61 2 51.2 311.8
30 -2 1 1 19.95 39.9 0.221 14.52 2 45.9 249.5
31 -1 2 1 19.957 39.915 0.222 14.5 2 43.5 223.1
32 0 2 1 20.024 40.048 0.222 14.4 2 7.8 7.1
33 0 -3 1 20.355 40.71 0.226 13.88 2 38.1 164.2
34 -2 -1 2 21.05 42.1 0.233 12.88 2 22.0 50.6
35 2 1 0 21.069 42.137 0.233 12.85 2 6.7 4.7
36 -2 0 2 21.632 43.264 0.239 12.11 2 36.5 131.5
37 0 3 0 21.653 43.305 0.24 12.09 2 56.1 310.1
38 -1 -3 1 21.732 43.464 0.24 11.99 2 1.9 0.4
39 -1 1 2 21.773 43.545 0.241 11.94 2 33.0 105.6
40 -2 -2 1 21.88 43.761 0.242 11.81 2 53.9 278.9
41 -2 -2 2 22.977 45.953 0.253 10.57 2 53.9 249.7
42 -1 3 0 23.016 46.033 0.254 10.53 2 49.4 208.9
43 -2 2 0 23.137 46.273 0.255 10.41 2 66.2 371.3
44 0 1 2 23.249 46.498 0.256 10.3 2 85.1 607.4
45 -1 -3 2 23.347 46.695 0.257 10.2 2 48.9 198.6
46 1 -3 1 23.466 46.932 0.258 10.08 2 32.1 84.5
47 0 -3 2 23.719 47.437 0.261 9.84 2 20.0 32.2
48 1 -1 2 23.847 47.695 0.262 9.72 2 21.4 36.3
49 -2 2 1 24.307 48.614 0.267 9.31 2 0.5 0.0
50 2 -1 1 24.43 48.859 0.268 9.2 2 45.0 151.9
51 1 2 1 24.477 48.955 0.269 9.16 2 33.8 85.1
52 -2 1 2 24.581 49.163 0.27 9.07 2 6.7 3.3
53 1 3 0 24.585 49.171 0.27 9.07 2 25.2 46.8
54 1 -2 2 24.858 49.716 0.273 8.84 2 78.7 446.2
55 2 0 1 24.882 49.765 0.273 8.82 2 26.7 51.1
56 1 0 2 25.138 50.277 0.276 8.62 2 23.3 38.1
57 2 2 0 25.205 50.409 0.276 8.57 2 32.7 74.4
58 -1 -1 3 25.951 51.902 0.284 8.02 2 15.5 15.7
59 2 -2 1 26.228 52.455 0.287 7.83 2 9.3 5.5
60 -1 -2 3 26.358 52.715 0.288 7.74 2 30.0 56.7
61 -1 3 1 26.79 53.579 0.293 7.46 2 62.4 236.4
62 -2 -3 2 26.992 53.984 0.295 7.33 2 69.8 290.9
63 -2 -3 1 27.055 54.109 0.295 7.29 2 15.5 14.3
64 -3 0 1 27.064 54.127 0.295 7.29 2 16.1 15.4
65 0 3 1 27.082 54.163 0.296 7.28 2 59.2 207.9
66 -1 2 2 27.159 54.318 0.296 7.23 2 4.2 1.0
67 0 -4 1 27.45 54.901 0.299 7.06 2 69.9 281.0
68 -2 -1 3 27.474 54.949 0.299 7.04 2 32.3 60.0
69 2 1 1 27.505 55.01 0.3 7.02 2 22.9 30.1
70 -1 0 3 27.704 55.408 0.302 6.91 2 31.4 55.6
71 -3 -1 1 27.824 55.648 0.303 6.84 2 16.9 15.8
72 1 -3 2 27.988 55.975 0.305 6.75 2 24.5 32.9
73 -2 -2 3 28.099 56.197 0.306 6.69 2 18.7 19.1
74 -2 3 0 28.199 56.397 0.307 6.64 2 42.4 97.2
75 0 -1 3 28.236 56.471 0.307 6.62 2 95.4 490.0
76 -3 -1 2 28.309 56.618 0.308 6.58 2 49.4 130.9
77 0 -2 3 28.39 56.78 0.309 6.54 2 39.1 81.2
78 -3 1 1 28.412 56.825 0.309 6.53 2 9.5 4.8
79 1 1 2 28.502 57.004 0.31 6.48 2 9.0 4.3
80 -3 0 2 28.55 57.1 0.31 6.45 2 34.3 62.0
81 0 2 2 28.655 57.309 0.311 6.4 2 75.8 299.5
82 -1 -4 1 28.793 57.585 0.313 6.33 2 30.6 48.1
83 -1 -3 3 28.861 57.722 0.313 6.3 2 66.1 224.1
84 -2 0 3 28.937 57.875 0.314 6.26 2 29.9 45.6
85 -1 -4 2 29.17 58.34 0.316 6.15 2 75.4 284.7
86 0 -4 2 29.262 58.525 0.317 6.11 2 45.5 103.0
87 -2 2 2 29.363 58.727 0.318 6.06 2 26.7 35.2
88 3 0 0 29.439 58.877 0.319 6.02 2 68.8 232.3
89 0 4 0 29.47 58.94 0.319 6.01 2 42.8 89.5
90 -3 1 0 29.773 59.546 0.322 5.87 2 41.3 81.5
91 1 -4 1 29.782 59.564 0.322 5.87 2 79.3 300.6
92 2 -3 1 29.988 59.977 0.324 5.78 2 26.1 32.0
93 -3 -2 2 30.107 60.215 0.326 5.73 2 27.5 35.4
94 0 0 3 30.121 60.242 0.326 5.72 2 45.4 95.9
95 -2 3 1 30.179 60.358 0.326 5.7 2 51.7 123.8
96 -1 4 0 30.356 60.711 0.328 5.62 2 50.1 114.8
97 0 -3 3 30.564 61.128 0.33 5.54 2 44.5 89.4
98 -3 -2 1 30.591 61.181 0.33 5.53 2 46.0 95.4
99 -2 -3 3 30.727 61.455 0.332 5.47 2 73.1 238.1
100 -3 1 2 30.8 61.599 0.332 5.44 2 119.4 631.5
101 2 3 0 30.9 61.8 0.333 5.41 2 18.2 14.6
102 1 3 1 30.987 61.973 0.334 5.37 2 45.1 89.0
103 3 1 0 31.1 62.199 0.335 5.33 2 88.5 339.9
104 -1 1 3 31.372 62.745 0.338 5.23 2 12.7 6.9
105 -3 2 1 31.695 63.391 0.341 5.11 2 35.5 52.6
106 2 2 1 31.934 63.868 0.343 5.03 2 94.2 363.5
107 -3 2 0 32.066 64.132 0.345 4.98 2 0.5 0.0
108 2 -1 2 32.095 64.19 0.345 4.97 2 41.8 70.6
109 1 4 0 32.098 64.196 0.345 4.97 2 41.9 71.2
110 -2 1 3 32.307 64.613 0.347 4.9 2 87.8 307.7
111 -3 -1 3 32.449 64.897 0.348 4.86 2 80.3 255.1
112 -2 -4 2 32.575 65.149 0.349 4.82 2 30.2 35.7
113 2 -2 2 32.721 65.441 0.351 4.77 2 44.8 78.0
114 1 -4 2 32.834 65.668 0.352 4.74 2 56.6 123.5
115 -1 -4 3 33.155 66.31 0.355 4.64 2 5.2 1.0
116 -3 -2 3 33.226 66.451 0.356 4.62 2 45.4 77.5
117 2 0 2 33.378 66.756 0.357 4.57 2 90.1 302.0
118 -2 -4 1 33.531 67.062 0.359 4.53 2 57.6 122.3
119 1 2 2 33.536 67.073 0.359 4.53 2 3.6 0.5
120 -3 0 3 33.571 67.142 0.359 4.52 2 6.5 1.5
121 -3 -3 2 33.747 67.495 0.361 4.47 2 47.3 81.4
122 1 -2 3 33.753 67.506 0.361 4.47 2 41.2 61.7
123 -1 3 2 33.795 67.589 0.361 4.45 2 31.8 36.8
124 1 -1 3 33.823 67.646 0.361 4.45 2 33.5 40.8
125 0 1 3 33.839 67.678 0.361 4.44 2 30.7 34.1
126 -1 4 1 34.453 68.905 0.367 4.28 2 8.5 2.5
127 0 -4 3 34.531 69.063 0.368 4.26 2 61.3 130.3
128 3 2 0 34.591 69.181 0.369 4.25 2 47.1 76.6
129 -2 4 0 34.599 69.199 0.369 4.24 2 22.6 17.7
130 3 -1 1 34.617 69.234 0.369 4.24 2 52.3 94.4
131 -3 2 2 34.83 69.661 0.371 4.19 2 2.9 0.3
132 0 4 1 34.911 69.822 0.371 4.17 2 61.9 130.2
133 -3 -3 1 35.083 70.165 0.373 4.13 2 78.5 206.8
134 -2 -4 3 35.096 70.193 0.373 4.12 2 35.1 41.3
135 3 0 1 35.188 70.377 0.374 4.1 2 20.6 14.2
136 2 -3 2 35.203 70.406 0.374 4.1 2 37.3 46.5
137 0 -5 1 35.321 70.643 0.375 4.07 2 32.8 35.7
138 0 3 2 35.326 70.651 0.375 4.07 2 61.9 127.1
139 2 -4 1 35.341 70.682 0.375 4.06 2 53.8 95.6
140 1 -3 3 35.538 71.076 0.377 4.02 2 44.0 63.4
141 -2 3 2 35.553 71.106 0.377 4.02 2 73.2 175.4
142 1 0 3 35.742 71.484 0.379 3.97 2 17.1 9.4
143 -3 -3 3 35.841 71.681 0.38 3.95 2 70.7 160.7
144 -1 -2 4 35.873 71.745 0.38 3.95 2 19.0 11.6
145 3 -2 1 35.887 71.774 0.381 3.94 2 64.2 132.3
146 0 -5 2 36.05 72.1 0.382 3.91 2 10.9 3.8
147 -2 -2 4 36.106 72.212 0.383 3.9 2 23.1 16.9
148 -3 3 0 36.114 72.227 0.383 3.9 2 25.8 21.0
149 -1 -5 2 36.17 72.341 0.383 3.88 2 41.0 53.2
150 -1 -1 4 36.4 72.799 0.385 3.84 2 42.6 56.6
151 -2 -1 4 36.43 72.86 0.385 3.83 2 65.1 132.3
152 2 1 2 36.469 72.938 0.386 3.82 2 0.2 0.0
153 -3 1 3 36.507 73.014 0.386 3.82 2 0.5 0.0
154 -3 3 1 36.628 73.256 0.387 3.79 2 79.6 195.7
155 -1 2 3 36.641 73.282 0.387 3.79 2 40.1 49.5
156 -1 -5 1 36.698 73.395 0.388 3.78 2 14.3 6.3
157 -1 -3 4 37.16 74.32 0.392 3.69 2 73.1 160.8
158 1 -5 1 37.174 74.348 0.392 3.69 2 31.9 30.5
159 -2 4 1 37.241 74.483 0.393 3.68 2 5.9 1.0
160 -2 2 3 37.311 74.622 0.393 3.66 2 11.3 3.8
161 3 1 1 37.566 75.132 0.396 3.62 2 13.5 5.3
162 -2 -3 4 37.59 75.181 0.396 3.61 2 49.9 73.4
163 -4 0 1 37.705 75.409 0.397 3.59 2 32.9 31.6
164 -4 -1 2 37.729 75.457 0.397 3.59 2 59.0 101.6
165 -4 0 2 37.738 75.475 0.397 3.59 2 5.4 0.8
166 2 4 0 37.842 75.683 0.398 3.57 2 41.1 49.2
167 2 3 1 37.852 75.704 0.398 3.57 2 12.7 4.7
168 0 5 0 37.949 75.899 0.399 3.55 2 30.1 26.2
169 -1 5 0 38.538 77.076 0.404 3.46 2 31.6 28.2
170 -4 -1 1 38.544 77.088 0.404 3.46 2 25.1 17.8
171 -2 0 4 38.545 77.09 0.404 3.46 2 4.9 0.7
172 1 4 1 38.569 77.138 0.405 3.45 2 46.5 60.8
173 -4 1 1 38.649 77.299 0.405 3.44 2 85.9 206.9
174 -1 0 4 38.713 77.427 0.406 3.43 2 59.6 99.3
175 0 -2 4 38.832 77.665 0.407 3.41 2 42.4 49.9
176 3 -3 1 38.925 77.85 0.408 3.4 2 36.0 35.9
177 -1 -5 3 38.968 77.935 0.408 3.39 2 19.6 10.6
178 -3 -4 2 38.989 77.978 0.408 3.39 2 29.3 23.7
179 1 -4 3 39.069 78.139 0.409 3.38 2 9.1 2.3
180 1 -5 2 39.115 78.23 0.41 3.37 2 27.7 21.1
181 0 2 3 39.15 78.3 0.41 3.37 2 1.6 0.1
182 2 -4 2 39.391 78.781 0.412 3.33 2 69.8 132.1
183 1 1 3 39.398 78.795 0.412 3.33 2 57.5 89.6
184 -2 -5 2 39.465 78.93 0.413 3.32 2 17.4 8.2
185 -4 -2 2 39.498 78.995 0.413 3.32 2 30.1 24.4
186 -3 -2 4 39.512 79.025 0.413 3.32 2 20.9 11.8
187 -4 1 2 39.524 79.047 0.413 3.32 2 20.7 11.6
188 0 -1 4 39.542 79.084 0.413 3.31 2 17.4 8.2
189 -3 -1 4 39.63 79.261 0.414 3.3 2 19.1 9.8
190 3 3 0 39.701 79.402 0.415 3.29 2 20.0 10.7
191 0 -3 4 39.891 79.782 0.416 3.27 2 51.0 69.2
192 1 3 2 39.989 79.978 0.417 3.26 2 53.0 74.6
193 0 -5 3 40.068 80.135 0.418 3.25 2 34.0 30.5
194 -3 -4 3 40.148 80.295 0.419 3.24 2 12.0 3.8
195 -4 -1 3 40.199 80.397 0.419 3.23 2 16.4 7.1
196 -1 -4 4 40.2 80.4 0.419 3.23 2 7.5 1.5
197 -3 3 2 40.425 80.85 0.421 3.2 2 30.9 24.9
198 1 5 0 40.505 81.01 0.422 3.19 2 27.8 20.1
199 -2 -4 4 40.816 81.632 0.424 3.16 2 11.7 3.5
200 4 0 0 40.944 81.888 0.425 3.14 2 4.5 0.5
201 -2 -5 3 40.995 81.989 0.426 3.14 2 11.0 3.1
202 -4 1 0 41.039 82.079 0.426 3.13 2 25.1 16.1
203 -4 0 3 41.041 82.082 0.426 3.13 2 11.5 3.4
204 -3 -4 1 41.09 82.18 0.427 3.13 2 17.4 7.7
205 -4 -2 3 41.11 82.221 0.427 3.13 2 12.5 4.0
206 -3 2 3 41.111 82.222 0.427 3.13 2 4.0 0.4
207 -4 -2 1 41.135 82.271 0.427 3.12 2 24.9 15.7
208 -3 -3 4 41.152 82.304 0.427 3.12 2 33.6 28.6
209 -2 -5 1 41.187 82.373 0.427 3.12 2 43.7 48.6
210 2 2 2 41.218 82.435 0.428 3.11 2 19.7 9.9
211 -4 2 1 41.343 82.686 0.429 3.1 2 0.2 0.0
212 -3 0 4 41.502 83.005 0.43 3.09 2 22.8 13.1
213 -1 4 2 41.592 83.183 0.431 3.08 2 29.5 21.8
214 3 2 1 41.645 83.289 0.431 3.07 2 13.3 4.4
215 -3 4 0 41.736 83.472 0.432 3.06 2 22.1 12.1
216 2 -2 3 41.844 83.688 0.433 3.05 2 61.7 94.5
217 0 0 4 41.998 83.996 0.434 3.04 2 6.6 1.1
218 2 -1 3 42.103 84.206 0.435 3.03 2 3.4 0.3
219 2 -5 1 42.109 84.218 0.435 3.03 2 24.7 15.1
220 -2 5 0 42.236 84.473 0.436 3.02 2 67.4 111.6
221 -2 1 4 42.372 84.743 0.437 3.01 2 4.7 0.5
222 3 -1 2 42.408 84.817 0.438 3.0 2 6.1 0.9
223 4 1 0 42.594 85.188 0.439 2.99 2 0.4 0.0
224 0 -4 4 42.688 85.375 0.44 2.98 2 2.4 0.1
225 -1 1 4 42.73 85.46 0.44 2.98 2 71.3 123.2
226 3 -2 2 42.783 85.566 0.441 2.97 2 15.2 5.6
227 -4 2 0 42.878 85.756 0.442 2.96 2 25.2 15.3
228 -4 -3 2 42.988 85.976 0.443 2.95 2 38.5 35.7
229 -4 2 2 43.031 86.062 0.443 2.95 2 12.6 3.8
230 -2 4 2 43.05 86.101 0.443 2.95 2 3.7 0.3
231 -3 4 1 43.057 86.114 0.443 2.95 2 10.7 2.8
232 -1 5 1 43.119 86.238 0.444 2.94 2 52.6 66.4
233 0 4 2 43.222 86.444 0.445 2.94 2 7.3 1.3
234 2 -3 3 43.326 86.651 0.445 2.93 2 24.5 14.3
235 -1 3 3 43.37 86.74 0.446 2.93 2 76.4 139.2
236 -4 1 3 43.619 87.237 0.448 2.91 2 7.0 1.2
237 3 -4 1 43.634 87.268 0.448 2.91 2 27.2 17.5
238 0 5 1 43.742 87.484 0.449 2.9 2 28.3 19.0
239 -4 -3 3 43.756 87.513 0.449 2.9 2 30.4 21.9
240 3 0 2 43.772 87.543 0.449 2.9 2 15.0 5.3
241 -2 3 3 43.822 87.644 0.449 2.9 2 26.2 16.2
242 0 -6 2 44.081 88.162 0.452 2.88 2 29.1 19.8
243 2 0 3 44.099 88.197 0.452 2.88 2 12.1 3.4
244 0 -6 1 44.214 88.429 0.453 2.87 2 69.0 111.3
245 1 -5 3 44.247 88.495 0.453 2.87 2 11.3 3.0
246 -1 -6 2 44.389 88.778 0.454 2.86 2 21.4 10.7
247 -3 -4 4 44.515 89.029 0.455 2.85 2 22.5 11.8
248 1 2 3 44.698 89.396 0.457 2.84 2 39.6 36.4
249 1 -2 4 44.809 89.618 0.457 2.84 2 24.0 13.3
250 3 -3 2 44.892 89.784 0.458 2.83 2 39.0 35.0
251 -1 -5 4 44.921 89.842 0.458 2.83 2 17.0 6.6
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 0 7.065 14.13 6.26281 339.9 9.5 9.6 5.6
2 1 0 0 9.429 18.859 4.70169 402.5 11.2 11.3 5.6
3 0 0 1 9.629 19.259 4.60485 57.3 1.6 1.6 5.6
4 0 -1 1 9.759 19.517 4.54443 115.8 3.2 3.3 5.6
5 -1 0 1 10.622 21.243 4.17896 729.5 20.4 20.5 5.6
6 -1 -1 1 11.255 22.51 3.94656 178.2 5.0 5.0 5.6
7 -1 1 0 11.33 22.66 3.92075 252.8 7.1 7.1 5.6
8 1 1 0 12.294 24.588 3.61758 148.8 4.2 4.2 5.6
9 0 -2 1 14.147 28.293 3.15166 3581.8 100.0 100.0 5.6
10 -1 1 1 14.192 28.384 3.14177 2525.6 70.5 70.5 5.6
11 0 2 0 14.24 28.48 3.1314 823.5 23.0 23.0 5.6
12 -1 -2 1 15.617 31.233 2.86138 387.8 10.8 10.8 5.6
13 1 -1 1 15.68 31.361 2.85002 53.5 1.5 1.5 5.6
14 1 0 1 15.967 31.933 2.80022 2682.8 74.9 74.7 5.6
15 -1 2 0 16.494 32.988 2.71304 274.0 7.6 7.6 5.6
16 -1 -1 2 17.136 34.272 2.6143 1365.7 38.1 37.9 5.7
17 -2 0 1 17.82 35.639 2.51707 1209.1 33.8 33.5 5.7
18 1 2 0 17.863 35.726 2.51118 968.5 27.0 26.9 5.7
19 -1 0 2 18.154 36.307 2.4723 165.8 4.6 4.6 5.7
20 0 -1 2 18.272 36.543 2.45686 36.5 1.0 1.0 5.7
21 1 -2 1 18.5 37.0 2.42759 202.7 5.7 5.6 5.7
22 -2 -1 1 18.543 37.087 2.42208 548.0 15.3 15.2 5.7
23 -1 -2 2 19.076 38.151 2.35692 45.0 1.3 1.2 5.7
24 2 0 0 19.127 38.254 2.35085 220.3 6.2 6.1 5.7
25 1 1 1 19.236 38.472 2.33801 208.7 5.8 5.8 5.7
26 0 0 2 19.545 39.091 2.30242 326.1 9.1 9.0 5.7
27 0 -2 2 19.816 39.632 2.27221 45.5 1.3 1.3 5.7
28 -2 1 0 19.89 39.78 2.26408 311.8 8.7 8.6 5.7
29 -2 1 1 19.95 39.9 2.25759 472.6 13.2 13.1 5.7
30 0 -3 1 20.355 40.71 2.21448 164.2 4.6 4.5 5.7
31 -2 -1 2 21.05 42.1 2.14454 55.3 1.5 1.5 5.7
32 0 3 0 21.653 43.305 2.0876 441.6 12.3 12.2 5.7
33 -1 1 2 21.773 43.545 2.07664 105.6 2.9 2.9 5.7
34 -2 -2 1 21.88 43.761 2.06692 278.9 7.8 7.7 5.7
35 -2 -2 2 22.977 45.953 1.97328 249.7 7.0 6.9 5.7
36 -1 3 0 23.016 46.033 1.97006 208.9 5.8 5.7 5.7
37 -2 2 0 23.137 46.273 1.96037 371.3 10.4 10.2 5.7
38 0 1 2 23.249 46.498 1.95143 607.4 17.0 16.7 5.7
39 -1 -3 2 23.347 46.695 1.94365 198.6 5.5 5.4 5.7
40 1 -3 1 23.466 46.932 1.93438 84.5 2.4 2.3 5.7
41 1 -1 2 23.847 47.695 1.90522 36.3 1.0 1.0 5.7
42 2 -1 1 24.43 48.859 1.86249 151.9 4.2 4.2 5.7
43 1 2 1 24.477 48.955 1.85907 85.1 2.4 2.3 5.7
44 1 3 0 24.585 49.171 1.85142 50.1 1.4 1.4 5.7
45 1 -2 2 24.858 49.716 1.83237 497.4 13.9 13.6 5.7
46 1 0 2 25.138 50.277 1.81326 38.1 1.1 1.0 5.8
47 2 2 0 25.205 50.409 1.80879 74.4 2.1 2.0 5.8
48 -1 -2 3 26.358 52.715 1.73497 56.7 1.6 1.5 5.8
49 -1 3 1 26.79 53.579 1.70902 236.4 6.6 6.4 5.8
50 -2 -3 2 26.992 53.984 1.69714 290.9 8.1 7.9 5.8
51 0 3 1 27.082 54.163 1.69196 237.6 6.6 6.5 5.8
52 0 -4 1 27.45 54.901 1.67096 341.0 9.5 9.3 5.8
53 -1 0 3 27.704 55.408 1.65687 55.6 1.6 1.5 5.8
54 -2 3 0 28.199 56.397 1.63011 97.2 2.7 2.6 5.8
55 0 -1 3 28.236 56.471 1.62815 490.0 13.7 13.3 5.8
56 -3 -1 2 28.309 56.618 1.62429 130.9 3.7 3.5 5.8
57 0 -2 3 28.39 56.78 1.62004 86.0 2.4 2.3 5.8
58 -3 0 2 28.55 57.1 1.61173 62.0 1.7 1.7 5.8
59 0 2 2 28.655 57.309 1.60633 299.5 8.4 8.1 5.8
60 -1 -4 1 28.793 57.585 1.59928 48.1 1.3 1.3 5.8
61 -1 -3 3 28.861 57.722 1.59583 224.1 6.3 6.1 5.8
62 -2 0 3 28.937 57.875 1.59197 45.6 1.3 1.2 5.8
63 -1 -4 2 29.17 58.34 1.58037 284.7 7.9 7.7 5.8
64 0 -4 2 29.262 58.525 1.57583 103.0 2.9 2.8 5.8
65 3 0 0 29.439 58.877 1.56723 232.3 6.5 6.3 5.8
66 0 4 0 29.47 58.94 1.5657 89.5 2.5 2.4 5.8
67 1 -4 1 29.782 59.564 1.5508 382.1 10.7 10.3 5.8
68 0 0 3 30.121 60.242 1.53495 131.2 3.7 3.5 5.8
69 -2 3 1 30.179 60.358 1.53228 123.8 3.5 3.3 5.8
70 -1 4 0 30.356 60.711 1.5242 114.8 3.2 3.1 5.8
71 -3 -2 1 30.591 61.181 1.51362 184.8 5.2 5.0 5.8
72 -2 -3 3 30.727 61.455 1.50753 238.1 6.6 6.4 5.8
73 -3 1 2 30.8 61.599 1.50434 631.5 17.6 17.0 5.8
74 1 3 1 30.987 61.973 1.49616 89.0 2.5 2.4 5.8
75 3 1 0 31.1 62.199 1.49126 339.9 9.5 9.1 5.8
76 -3 2 1 31.695 63.391 1.46607 52.6 1.5 1.4 5.9
77 2 2 1 31.934 63.868 1.45626 363.5 10.1 9.7 5.9
78 1 4 0 32.098 64.196 1.44961 141.9 4.0 3.8 5.9
79 -2 1 3 32.307 64.613 1.44126 307.7 8.6 8.2 5.9
80 -3 -1 3 32.449 64.897 1.43563 255.1 7.1 6.8 5.9
81 2 -2 2 32.721 65.441 1.42501 78.0 2.2 2.1 5.9
82 1 -4 2 32.834 65.668 1.42064 123.5 3.4 3.3 5.9
83 -3 -2 3 33.226 66.451 1.40578 77.5 2.2 2.1 5.9
84 2 0 2 33.378 66.756 1.40011 302.0 8.4 8.1 5.9
85 -2 -4 1 33.531 67.062 1.39445 122.8 3.4 3.3 5.9
86 -3 -3 2 33.747 67.495 1.38656 143.1 4.0 3.8 5.9
87 1 -1 3 33.823 67.646 1.38383 111.6 3.1 3.0 5.9
88 0 -4 3 34.531 69.063 1.35886 130.3 3.6 3.5 5.9
89 3 -1 1 34.617 69.234 1.35592 188.6 5.3 5.0 5.9
90 0 4 1 34.911 69.822 1.34593 130.2 3.6 3.5 5.9
91 -3 -3 1 35.083 70.165 1.34018 248.1 6.9 6.6 5.9
92 2 -3 2 35.203 70.406 1.33618 60.8 1.7 1.6 5.9
93 2 -4 1 35.341 70.682 1.33164 258.5 7.2 6.8 5.9
94 -2 3 2 35.553 71.106 1.32474 238.9 6.7 6.3 5.9
95 -3 -3 3 35.841 71.681 1.31552 160.7 4.5 4.2 5.9
96 3 -2 1 35.887 71.774 1.31405 143.9 4.0 3.8 5.9
97 -3 3 0 36.114 72.227 1.30692 38.0 1.1 1.0 5.9
98 -1 -5 2 36.17 72.341 1.30515 53.2 1.5 1.4 5.9
99 -1 -1 4 36.4 72.799 1.29805 56.6 1.6 1.5 6.0
100 -2 -1 4 36.43 72.86 1.29712 132.3 3.7 3.5 6.0
101 -3 3 1 36.628 73.256 1.29108 245.3 6.8 6.5 6.0
102 -1 -3 4 37.16 74.32 1.2752 191.3 5.3 5.0 6.0
103 -2 -3 4 37.59 75.181 1.26273 78.7 2.2 2.1 6.0
104 -4 -1 2 37.729 75.457 1.25878 133.2 3.7 3.5 6.0
105 2 4 0 37.842 75.683 1.25559 53.8 1.5 1.4 6.0
106 -1 5 0 38.538 77.076 1.23634 46.6 1.3 1.2 6.0
107 1 4 1 38.569 77.138 1.2355 60.8 1.7 1.6 6.0
108 -4 1 1 38.649 77.299 1.23333 206.9 5.8 5.4 6.0
109 -1 0 4 38.713 77.427 1.23161 99.3 2.8 2.6 6.0
110 0 -2 4 38.832 77.665 1.22843 49.9 1.4 1.3 6.0
111 3 -3 1 38.925 77.85 1.22597 35.9 1.0 0.9 6.0
112 2 -4 2 39.391 78.781 1.2138 221.7 6.2 5.8 6.0
113 -4 -2 2 39.498 78.995 1.21104 47.8 1.3 1.2 6.0
114 0 -3 4 39.891 79.782 1.20106 69.2 1.9 1.8 6.0
115 1 3 2 39.989 79.978 1.19862 74.6 2.1 1.9 6.0
116 -3 -3 4 41.152 82.304 1.17053 44.3 1.2 1.1 6.1
117 -2 -5 1 41.187 82.373 1.16973 48.6 1.4 1.3 6.1
118 2 -2 3 41.844 83.688 1.15466 94.5 2.6 2.4 6.1
119 -2 5 0 42.236 84.473 1.14592 111.6 3.1 2.9 6.1
120 -1 1 4 42.73 85.46 1.13519 123.2 3.4 3.2 6.1
121 -1 5 1 43.119 86.238 1.12694 66.4 1.9 1.7 6.1
122 -1 3 3 43.37 86.74 1.1217 139.2 3.9 3.6 6.1
123 -4 -3 3 43.756 87.513 1.11378 46.2 1.3 1.2 6.2
124 0 -6 1 44.214 88.429 1.10459 111.3 3.1 2.8 6.2
125 1 2 3 44.698 89.396 1.09513 36.4 1.0 0.9 6.2
126 3 -3 2 44.892 89.784 1.0914 41.6 1.2 1.1 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)
|