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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LAMMERITE
1, f-keyite
Cu(3)[AsO(4)](2)
Monoclinic P 2(1)/a Z = 2
R =0.031 NR =822
22 .11 .1989
Ref.Str.:
F.C. Hawthorne (1986)
* Amer. Mineral., 71, 206-209
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.079 alpha = 90.0
b = 11.611 beta = 111.72
c = 5.394 gamma = 90.0
Unit cell volume (cub. angs.) = 295.51
Molar volume ( cub.cm/mol.) = 89.0
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.5 0.5 1.25 Cu = 1.00
2 0.2462 0.8367 0.8563 1.48 Cu = 1.00
3 0.8889 0.8851 0.2625 0.96 As = 1.00
4 0.1921 0.9173 0.2203 1.3 O = 1.00
5 0.9054 0.8157 0.539 1.5 O = 1.00
6 0.1717 0.6871 0.9904 1.3 O = 1.00
7 0.2893 0.9902 0.7332 1.2 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.5 0.5
2 2 0.2462 0.8367 0.8563
3 3 0.8889 0.8851 0.2625
4 4 0.1921 0.9173 0.2203
5 5 0.9054 0.8157 0.539
6 6 0.1717 0.6871 0.9904
7 7 0.2893 0.9902 0.7332
8 2 0.7538 0.1633 0.1437
9 3 0.1111 0.1149 0.7375
10 4 0.8079 0.0827 0.7797
11 5 0.0946 0.1843 0.461
12 6 0.8283 0.3129 0.0096
13 7 0.7107 0.0098 0.2668
14 1 0.5 0.0 0.5
15 2 0.7462 0.6633 0.8563
16 3 0.3889 0.6149 0.2625
17 4 0.6921 0.5827 0.2203
18 5 0.4054 0.6843 0.539
19 6 0.6717 0.8129 0.9904
20 7 0.7893 0.5098 0.7332
21 2 0.2538 0.3367 0.1437
22 3 0.6111 0.3851 0.7375
23 4 0.3079 0.4173 0.7797
24 5 0.5946 0.3157 0.461
25 6 0.3283 0.1871 0.0096
26 7 0.2107 0.4902 0.2668
X-ray density (g/cm cub.) = 5.26
MU (1/cm) = 270.236 Mass attenuation coefficient (cm**2/g) = 51.345
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Cu 2.808 4
1.9742 4
1.9331 7
1.9742 4
1.9331 7
2 Cu 2.808 6
2.2816 4
1.9473 5
1.9713 6
1.9424 7
2.7818 5
2.0281 6
3 As 2.46 4
1.68 4
1.6698 5
1.7122 7
1.6957 6
4 O 3.264 9
2.8844 5
2.9322 6
2.7574 7
2.9704 7
3.1164 4
2.7686 7
2.7656 7
3.1732 5
2.7509 6
5 O 3.264 9
2.8844 4
2.7477 6
2.7373 7
2.6717 7
3.1732 4
2.9626 5
2.9626 5
3.0786 6
2.7508 6
6 O 3.264 9
2.9322 4
2.7477 5
2.7509 4
2.7508 5
3.0786 5
2.9296 6
2.9296 6
2.8179 7
2.6963 7
7 O 3.264 10
2.9704 4
2.7574 4
2.7373 5
2.7686 4
2.7656 4
2.6717 5
2.8909 7
3.0895 7
2.8179 6
2.6963 6
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 2 0 7.625 15.249 0.086 110.66 2 22.5 128.8
2 0 0 1 8.842 17.685 0.1 81.71 2 5.9 6.6
3 0 1 1 9.638 19.276 0.109 68.43 4 13.0 52.8
4 1 1 0 10.149 20.299 0.114 61.5 4 23.0 149.0
5 1 1 -1 10.954 21.908 0.123 52.49 4 62.9 952.6
6 0 2 1 11.716 23.432 0.132 45.62 4 79.2 1310.6
7 1 2 0 12.144 24.288 0.137 42.32 4 12.7 31.1
8 1 2 -1 12.83 25.66 0.144 37.7 4 30.1 156.4
9 0 3 1 14.565 29.129 0.163 28.8 4 103.4 1409.4
10 1 3 0 14.916 29.833 0.167 27.37 4 107.0 1436.6
11 0 4 0 15.388 30.777 0.172 25.6 2 96.0 540.7
12 1 3 -1 15.489 30.978 0.173 25.25 4 159.1 2926.3
13 1 1 1 15.703 31.406 0.176 24.51 4 120.5 1631.2
14 1 2 1 17.1 34.199 0.191 20.38 4 129.8 1573.1
15 1 1 -2 17.299 34.598 0.193 19.87 4 127.4 1477.0
16 2 0 -1 17.764 35.528 0.198 18.75 2 192.0 1583.0
17 0 4 1 17.859 35.717 0.199 18.54 4 70.9 427.3
18 0 0 2 17.905 35.809 0.2 18.43 2 73.0 225.2
19 1 4 0 18.153 36.306 0.202 17.88 4 34.3 96.5
20 2 1 -1 18.193 36.387 0.203 17.8 4 19.7 31.8
21 0 1 2 18.331 36.662 0.204 17.5 4 71.8 413.3
22 1 2 -2 18.589 37.179 0.207 16.97 4 7.7 4.6
23 1 4 -1 18.637 37.273 0.207 16.88 4 64.0 317.0
24 2 0 0 19.056 38.113 0.212 16.07 2 63.6 148.8
25 1 3 1 19.228 38.457 0.214 15.75 4 8.1 4.7
26 2 2 -1 19.433 38.865 0.216 15.39 4 1.9 0.3
27 2 1 0 19.461 38.923 0.216 15.34 4 53.1 198.2
28 0 2 2 19.563 39.126 0.217 15.16 4 14.7 15.1
29 1 3 -2 20.586 41.171 0.228 13.54 4 79.8 394.9
30 2 2 0 20.636 41.272 0.229 13.46 4 61.6 233.9
31 2 0 -2 20.862 41.725 0.231 13.14 2 74.5 166.8
32 2 1 -2 21.238 42.477 0.235 12.62 4 16.1 14.9
33 2 3 -1 21.363 42.726 0.236 12.46 4 9.5 5.2
34 0 5 1 21.444 42.888 0.237 12.35 4 25.1 35.7
35 0 3 2 21.483 42.967 0.238 12.3 4 11.2 7.1
36 1 5 0 21.697 43.394 0.24 12.03 4 107.0 631.2
37 1 4 1 21.912 43.825 0.242 11.77 4 3.5 0.7
38 1 5 -1 22.115 44.231 0.244 11.53 4 22.0 25.6
39 2 2 -2 22.336 44.672 0.247 11.27 4 66.1 225.3
40 2 3 0 22.481 44.962 0.248 11.11 4 61.7 193.8
41 1 4 -2 23.14 46.281 0.255 10.41 4 42.7 87.1
42 0 6 0 23.456 46.912 0.258 10.09 2 112.0 289.9
43 1 1 2 23.789 47.579 0.262 9.77 4 62.4 174.2
44 2 4 -1 23.851 47.701 0.262 9.72 4 77.8 269.2
45 0 4 2 23.961 47.922 0.264 9.61 4 122.7 662.7
46 2 3 -2 24.077 48.154 0.265 9.51 4 62.7 171.4
47 2 0 1 24.149 48.299 0.266 9.45 2 40.8 36.0
48 2 1 1 24.485 48.971 0.269 9.15 4 89.7 337.3
49 1 2 2 24.798 49.596 0.272 8.89 4 2.2 0.2
50 2 4 0 24.881 49.762 0.273 8.83 4 60.8 149.5
51 1 5 1 25.02 50.041 0.275 8.71 4 27.0 29.1
52 0 6 1 25.258 50.516 0.277 8.53 4 5.4 1.1
53 2 2 1 25.474 50.947 0.279 8.37 4 8.7 2.9
54 1 6 0 25.482 50.963 0.279 8.36 4 30.7 36.1
55 1 1 -3 25.695 51.39 0.281 8.2 4 68.0 173.5
56 1 6 -1 25.852 51.705 0.283 8.09 4 43.7 70.6
57 1 5 -2 26.136 52.272 0.286 7.89 4 12.7 5.8
58 2 4 -2 26.367 52.734 0.288 7.73 4 36.4 46.8
59 1 3 2 26.416 52.832 0.289 7.7 4 77.0 209.0
60 1 2 -3 26.65 53.301 0.291 7.55 4 12.6 5.5
61 2 5 -1 26.787 53.574 0.293 7.46 4 46.0 72.2
62 0 5 2 26.889 53.778 0.294 7.4 4 72.9 180.3
63 2 3 1 27.062 54.125 0.295 7.29 4 5.2 0.9
64 2 0 -3 27.121 54.242 0.296 7.25 2 89.4 132.7
65 3 1 -1 27.427 54.853 0.299 7.07 4 26.3 22.3
66 2 1 -3 27.431 54.861 0.299 7.07 4 16.6 8.9
67 0 0 3 27.461 54.923 0.299 7.05 2 84.8 116.2
68 2 5 0 27.738 55.477 0.302 6.89 4 36.5 42.1
69 0 1 3 27.768 55.537 0.302 6.87 4 93.7 276.4
70 1 3 -3 28.193 56.386 0.307 6.64 4 52.4 83.4
71 3 2 -1 28.342 56.683 0.308 6.56 4 22.8 15.7
72 2 2 -3 28.346 56.691 0.308 6.56 4 64.3 124.3
73 1 6 1 28.473 56.947 0.309 6.49 4 69.2 142.4
74 3 1 -2 28.476 56.952 0.309 6.49 4 35.2 36.8
75 1 4 2 28.572 57.143 0.31 6.44 4 25.5 19.2
76 0 2 3 28.676 57.352 0.311 6.39 4 6.4 1.2
77 2 5 -2 29.122 58.244 0.316 6.17 4 31.2 27.6
78 2 4 1 29.186 58.371 0.317 6.14 4 84.1 198.9
79 0 7 1 29.286 58.571 0.318 6.09 4 131.8 485.0
80 3 2 -2 29.37 58.739 0.318 6.06 4 73.8 151.2
81 1 7 0 29.488 58.976 0.32 6.0 4 23.0 14.5
82 1 6 -2 29.498 58.997 0.32 6.0 4 72.7 145.3
83 3 1 0 29.619 59.237 0.321 5.94 4 64.3 112.5
84 1 7 -1 29.825 59.65 0.323 5.85 4 34.5 32.0
85 3 3 -1 29.826 59.652 0.323 5.85 4 10.4 2.9
86 2 3 -3 29.83 59.659 0.323 5.85 4 25.1 16.9
87 2 6 -1 30.101 60.201 0.326 5.73 4 59.6 93.1
88 0 3 3 30.15 60.3 0.326 5.71 4 67.9 120.6
89 0 6 2 30.195 60.39 0.326 5.69 4 65.8 112.8
90 1 4 -3 30.264 60.529 0.327 5.66 4 61.7 98.7
91 3 2 0 30.491 60.982 0.329 5.57 4 140.0 500.1
92 3 3 -2 30.823 61.646 0.333 5.44 4 142.8 507.8
93 2 6 0 30.985 61.971 0.334 5.37 4 39.8 38.9
94 1 5 2 31.199 62.398 0.336 5.29 4 60.4 88.4
95 2 0 2 31.654 63.309 0.341 5.13 2 50.8 30.3
96 2 5 1 31.782 63.564 0.342 5.08 4 67.2 105.2
97 3 4 -1 31.832 63.664 0.342 5.06 4 45.3 47.6
98 2 4 -3 31.836 63.671 0.342 5.06 4 146.7 499.1
99 3 3 0 31.914 63.828 0.343 5.04 4 9.8 2.2
100 2 1 2 31.936 63.872 0.343 5.03 4 98.0 221.2
101 0 8 0 32.054 64.109 0.345 4.99 2 54.9 34.4
102 0 4 3 32.144 64.288 0.345 4.96 4 8.6 1.7
103 1 7 1 32.235 64.47 0.346 4.93 4 106.4 255.6
104 2 6 -2 32.283 64.566 0.347 4.91 4 37.2 31.1
105 3 1 -3 32.567 65.135 0.349 4.82 4 100.7 223.9
106 2 2 2 32.773 65.545 0.351 4.75 4 34.3 25.5
107 3 4 -2 32.794 65.587 0.352 4.75 4 21.2 9.8
108 1 5 -3 32.811 65.621 0.352 4.74 4 15.5 5.2
109 1 1 3 33.175 66.351 0.355 4.63 4 9.7 2.0
110 1 7 -2 33.19 66.381 0.355 4.63 4 83.3 147.0
111 3 2 -3 33.396 66.791 0.357 4.57 4 2.4 0.1
112 0 8 1 33.541 67.082 0.359 4.53 4 54.6 61.9
113 1 8 0 33.729 67.458 0.36 4.47 4 76.8 120.8
114 2 7 -1 33.755 67.51 0.361 4.47 4 20.7 8.8
115 0 7 2 33.844 67.687 0.362 4.44 4 35.3 25.3
116 3 4 0 33.85 67.7 0.362 4.44 4 40.0 32.5
117 1 2 3 33.996 67.992 0.363 4.4 4 129.0 335.1
118 1 8 -1 34.042 68.084 0.363 4.39 4 63.1 79.9
119 2 3 2 34.143 68.287 0.364 4.36 4 47.3 44.7
120 1 6 2 34.25 68.5 0.365 4.33 4 42.7 36.2
121 3 5 -1 34.314 68.628 0.366 4.32 4 130.3 335.5
122 2 5 -3 34.318 68.635 0.366 4.31 4 17.0 5.7
123 2 7 0 34.588 69.176 0.368 4.25 4 59.5 68.8
124 0 5 3 34.615 69.229 0.369 4.24 4 56.9 62.8
125 3 1 1 34.671 69.342 0.369 4.23 4 50.0 48.3
126 3 3 -3 34.754 69.508 0.37 4.2 4 49.5 47.2
127 2 6 1 34.806 69.612 0.371 4.19 4 96.9 180.4
128 3 5 -2 35.242 70.483 0.375 4.09 4 56.4 59.6
129 1 3 3 35.344 70.687 0.375 4.06 4 29.8 16.5
130 1 1 -4 35.355 70.709 0.376 4.06 4 2.4 0.1
131 2 0 -4 35.431 70.862 0.376 4.04 2 46.6 20.1
132 3 2 1 35.475 70.951 0.377 4.03 4 61.2 69.2
133 2 1 -4 35.697 71.395 0.379 3.98 4 24.6 11.1
134 1 6 -3 35.791 71.582 0.38 3.96 4 29.1 15.4
135 2 7 -2 35.818 71.636 0.38 3.96 4 107.9 211.1
136 2 4 2 36.02 72.04 0.382 3.92 4 49.9 44.7
137 1 2 -4 36.152 72.305 0.383 3.89 4 109.8 214.7
138 3 5 0 36.264 72.528 0.384 3.86 4 19.6 6.8
139 1 8 1 36.302 72.605 0.384 3.86 4 3.9 0.3
140 2 2 -4 36.492 72.984 0.386 3.82 4 2.1 0.1
141 3 4 -3 36.617 73.234 0.387 3.79 4 69.9 84.9
142 3 3 1 36.799 73.598 0.389 3.76 4 28.9 14.3
143 1 4 3 37.194 74.389 0.392 3.68 4 32.1 17.3
144 1 8 -2 37.209 74.418 0.393 3.68 4 32.9 18.2
145 3 6 -1 37.239 74.479 0.393 3.68 4 19.8 6.6
146 2 6 -3 37.243 74.486 0.393 3.68 4 10.7 1.9
147 1 3 -4 37.467 74.933 0.395 3.63 4 78.8 103.3
148 0 6 3 37.53 75.06 0.395 3.62 4 78.7 102.8
149 4 0 -2 37.604 75.207 0.396 3.61 2 65.2 35.1
150 1 7 2 37.7 75.4 0.397 3.59 4 7.8 1.0
151 2 8 -1 37.747 75.493 0.397 3.59 4 63.4 66.1
152 2 3 -4 37.802 75.604 0.398 3.58 4 53.1 46.1
153 4 0 -1 37.805 75.611 0.398 3.58 2 20.7 3.5
154 0 8 2 37.831 75.662 0.398 3.57 4 43.2 30.5
155 4 1 -2 37.864 75.728 0.398 3.57 4 49.7 40.4
156 0 0 4 37.942 75.884 0.399 3.55 2 71.3 41.4
157 0 9 1 38.064 76.127 0.4 3.53 4 7.5 0.9
158 4 1 -1 38.065 76.131 0.4 3.53 4 71.1 81.7
159 3 6 -2 38.137 76.275 0.401 3.52 4 48.2 37.5
160 0 1 4 38.202 76.404 0.401 3.51 4 36.9 21.8
161 2 7 1 38.235 76.471 0.402 3.51 4 43.6 30.6
162 1 9 0 38.242 76.483 0.402 3.5 4 12.2 2.4
163 2 5 2 38.377 76.754 0.403 3.48 4 81.7 106.5
164 1 9 -1 38.539 77.079 0.404 3.46 4 25.9 10.7
165 2 8 0 38.544 77.088 0.404 3.46 4 57.1 51.6
166 3 4 1 38.623 77.246 0.405 3.45 4 0.0 0.0
167 4 2 -2 38.642 77.284 0.405 3.44 4 43.2 29.4
168 4 2 -1 38.842 77.684 0.407 3.41 4 66.3 68.6
169 3 5 -3 38.961 77.922 0.408 3.4 4 3.0 0.1
170 0 2 4 38.978 77.955 0.408 3.39 4 62.5 60.8
171 3 6 0 39.132 78.263 0.41 3.37 4 50.0 38.6
172 1 7 -3 39.187 78.374 0.41 3.36 4 48.0 35.5
173 3 1 -4 39.199 78.397 0.41 3.36 4 69.3 74.0
174 1 4 -4 39.28 78.561 0.411 3.35 4 56.1 48.3
175 1 5 3 39.527 79.054 0.413 3.32 4 35.4 19.0
176 2 4 -4 39.611 79.221 0.414 3.3 4 7.7 0.9
177 2 8 -2 39.727 79.455 0.415 3.29 4 33.1 16.5
178 4 3 -2 39.928 79.857 0.417 3.26 4 24.0 8.6
179 3 2 -4 39.969 79.938 0.417 3.26 4 4.3 0.3
180 4 3 -1 40.127 80.253 0.418 3.24 4 51.5 39.4
181 4 0 -3 40.175 80.35 0.419 3.23 2 45.6 15.4
182 0 3 4 40.261 80.522 0.42 3.22 4 8.7 1.1
183 4 1 -3 40.431 80.862 0.421 3.2 4 22.0 7.1
184 3 7 -1 40.595 81.189 0.422 3.18 4 42.7 26.6
185 2 7 -3 40.598 81.196 0.422 3.18 4 4.9 0.4
186 1 9 1 40.706 81.412 0.423 3.17 4 34.7 17.5
187 4 0 0 40.768 81.536 0.424 3.16 2 21.1 3.2
188 0 7 3 40.878 81.757 0.425 3.15 4 38.0 20.8
189 3 5 1 40.932 81.863 0.425 3.15 4 40.1 23.1
190 2 0 3 41.017 82.033 0.426 3.14 2 34.8 8.7
191 4 1 0 41.023 82.046 0.426 3.14 4 35.2 17.8
192 4 2 -3 41.195 82.391 0.428 3.12 4 2.1 0.1
193 2 6 2 41.199 82.397 0.428 3.12 4 56.4 45.4
194 3 3 -4 41.245 82.489 0.428 3.11 4 25.8 9.5
195 2 1 3 41.271 82.542 0.428 3.11 4 13.0 2.4
196 3 7 -2 41.472 82.944 0.43 3.09 4 3.9 0.2
197 1 8 2 41.553 83.106 0.431 3.08 4 26.7 10.1
198 0 10 0 41.56 83.12 0.431 3.08 2 49.8 17.5
199 1 5 -4 41.58 83.159 0.431 3.08 4 51.2 37.0
200 1 9 -2 41.583 83.166 0.431 3.08 4 12.6 2.2
201 4 4 -2 41.713 83.426 0.432 3.07 4 25.4 9.0
202 3 6 -3 41.773 83.545 0.432 3.06 4 34.0 16.2
203 4 2 0 41.785 83.571 0.433 3.06 4 8.1 0.9
204 2 5 -4 41.906 83.812 0.434 3.05 4 5.6 0.4
205 4 4 -1 41.909 83.819 0.434 3.05 4 37.0 19.1
206 2 2 3 42.033 84.066 0.435 3.04 4 43.4 26.2
207 0 4 4 42.043 84.085 0.435 3.03 4 3.8 0.2
208 2 8 1 42.075 84.151 0.435 3.03 4 43.2 25.9
209 2 9 -1 42.106 84.211 0.435 3.03 4 33.3 15.4
210 3 1 2 42.143 84.285 0.436 3.03 4 30.0 12.4
211 0 9 2 42.188 84.376 0.436 3.02 4 16.1 3.6
212 1 6 3 42.33 84.66 0.437 3.01 4 49.6 33.9
213 3 7 0 42.447 84.895 0.438 3.0 4 29.9 12.3
214 4 3 -3 42.464 84.928 0.438 3.0 4 38.6 20.5
215 2 9 0 42.883 85.766 0.442 2.96 4 19.6 5.2
216 3 2 2 42.902 85.804 0.442 2.96 4 63.4 54.6
217 0 10 1 42.92 85.841 0.442 2.96 4 49.4 33.1
218 1 8 -3 43.008 86.016 0.443 2.95 4 55.2 41.3
219 3 4 -4 43.019 86.038 0.443 2.95 4 56.1 42.5
220 4 3 0 43.051 86.103 0.443 2.95 4 19.1 4.9
221 1 10 0 43.094 86.188 0.443 2.95 4 60.9 50.1
222 2 3 3 43.298 86.596 0.445 2.93 4 21.1 6.0
223 1 10 -1 43.384 86.768 0.446 2.93 4 57.0 43.6
224 3 6 1 43.719 87.437 0.449 2.9 4 29.6 11.6
225 4 5 -2 43.989 87.979 0.451 2.89 4 44.7 26.4
226 2 9 -2 44.044 88.087 0.451 2.88 4 9.4 1.2
227 1 1 4 44.049 88.098 0.451 2.88 4 9.8 1.3
228 3 3 2 44.164 88.329 0.452 2.87 4 3.8 0.2
229 4 5 -1 44.185 88.369 0.452 2.87 4 56.5 41.9
230 4 4 -3 44.232 88.465 0.453 2.87 4 3.7 0.2
231 0 5 4 44.317 88.635 0.453 2.87 4 34.6 15.7
232 1 6 -4 44.361 88.723 0.454 2.86 4 42.4 23.6
233 3 8 -1 44.394 88.789 0.454 2.86 4 48.2 30.5
234 2 8 -3 44.398 88.796 0.454 2.86 4 6.5 0.5
235 2 7 2 44.488 88.976 0.455 2.86 4 6.8 0.6
236 0 8 3 44.675 89.35 0.456 2.85 4 3.4 0.2
237 2 6 -4 44.686 89.371 0.456 2.84 4 68.9 61.9
238 1 2 4 44.806 89.611 0.457 2.84 4 57.2 42.5
239 4 4 0 44.818 89.636 0.458 2.84 4 53.2 36.8
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 2 0 7.625 15.249 5.8055 128.8 4.4 4.5 5.6
2 0 1 1 9.638 19.276 4.60085 52.8 1.8 1.8 5.6
3 1 1 0 10.149 20.299 4.37126 149.0 5.1 5.1 5.6
4 1 1 -1 10.954 21.908 4.05371 952.6 32.6 32.8 5.6
5 0 2 1 11.716 23.432 3.79338 1310.6 44.8 45.1 5.6
6 1 2 0 12.144 24.288 3.66158 31.1 1.1 1.1 5.6
7 1 2 -1 12.83 25.66 3.4688 156.4 5.3 5.4 5.6
8 0 3 1 14.565 29.129 3.06308 1409.4 48.2 48.2 5.6
9 1 3 0 14.916 29.833 2.99242 1436.6 49.1 49.1 5.6
10 0 4 0 15.388 30.777 2.90275 540.7 18.5 18.5 5.6
11 1 3 -1 15.489 30.978 2.88441 2926.3 100.0 100.0 5.6
12 1 1 1 15.703 31.406 2.84599 1631.2 55.7 55.7 5.6
13 1 2 1 17.1 34.199 2.61968 1573.1 53.8 53.6 5.7
14 1 1 -2 17.299 34.598 2.59044 1477.0 50.5 50.3 5.7
15 2 0 -1 17.764 35.528 2.5247 1583.0 54.1 53.9 5.7
16 0 4 1 17.859 35.717 2.51176 427.3 14.6 14.5 5.7
17 0 0 2 17.905 35.809 2.50552 225.2 7.7 7.7 5.7
18 1 4 0 18.153 36.306 2.47236 96.5 3.3 3.3 5.7
19 2 1 -1 18.193 36.387 2.46705 31.8 1.1 1.1 5.7
20 0 1 2 18.331 36.662 2.44915 413.3 14.1 14.1 5.7
21 1 4 -1 18.637 37.273 2.41039 317.0 10.8 10.8 5.7
22 2 0 0 19.056 38.113 2.3592 148.8 5.1 5.1 5.7
23 2 1 0 19.461 38.923 2.31196 198.2 6.8 6.7 5.7
24 1 3 -2 20.586 41.171 2.19073 394.9 13.5 13.4 5.7
25 2 2 0 20.636 41.272 2.18563 233.9 8.0 7.9 5.7
26 2 0 -2 20.862 41.725 2.16296 166.8 5.7 5.6 5.7
27 0 5 1 21.444 42.888 2.10696 35.7 1.2 1.2 5.7
28 1 5 0 21.697 43.394 2.08353 631.2 21.6 21.3 5.7
29 2 2 -2 22.336 44.672 2.02685 225.3 7.7 7.6 5.7
30 2 3 0 22.481 44.962 2.01445 193.8 6.6 6.5 5.7
31 1 4 -2 23.14 46.281 1.96008 87.1 3.0 2.9 5.7
32 0 6 0 23.456 46.912 1.93517 289.9 9.9 9.8 5.7
33 1 1 2 23.789 47.579 1.90958 174.2 6.0 5.9 5.7
34 2 4 -1 23.851 47.701 1.90497 269.2 9.2 9.0 5.7
35 0 4 2 23.961 47.922 1.89669 662.7 22.6 22.3 5.7
36 2 3 -2 24.077 48.154 1.88811 171.4 5.9 5.8 5.7
37 2 0 1 24.149 48.299 1.88278 36.0 1.2 1.2 5.7
38 2 1 1 24.485 48.971 1.85851 337.3 11.5 11.3 5.7
39 2 4 0 24.881 49.762 1.83079 149.5 5.1 5.0 5.7
40 1 6 0 25.482 50.963 1.79043 39.0 1.3 1.3 5.8
41 1 1 -3 25.695 51.39 1.77656 173.5 5.9 5.8 5.8
42 1 6 -1 25.852 51.705 1.76647 70.6 2.4 2.4 5.8
43 2 4 -2 26.367 52.734 1.7344 46.8 1.6 1.6 5.8
44 1 3 2 26.416 52.832 1.73142 209.0 7.1 7.0 5.8
45 2 5 -1 26.787 53.574 1.70916 72.2 2.5 2.4 5.8
46 0 5 2 26.889 53.778 1.70317 180.3 6.2 6.0 5.8
47 2 0 -3 27.121 54.242 1.68968 132.7 4.5 4.4 5.8
48 3 1 -1 27.427 54.853 1.67229 31.2 1.1 1.0 5.8
49 0 0 3 27.461 54.923 1.67035 116.2 4.0 3.9 5.8
50 2 5 0 27.738 55.477 1.65497 42.1 1.4 1.4 5.8
51 0 1 3 27.768 55.537 1.65333 276.4 9.4 9.2 5.8
52 1 3 -3 28.193 56.386 1.63043 83.4 2.9 2.8 5.8
53 2 2 -3 28.346 56.691 1.62236 140.0 4.8 4.7 5.8
54 1 6 1 28.473 56.947 1.61569 179.2 6.1 6.0 5.8
55 2 4 1 29.186 58.371 1.5796 198.9 6.8 6.6 5.8
56 0 7 1 29.286 58.571 1.57469 485.0 16.6 16.1 5.8
57 3 2 -2 29.37 58.739 1.57058 151.2 5.2 5.0 5.8
58 1 6 -2 29.498 58.997 1.56434 159.9 5.5 5.3 5.8
59 3 1 0 29.619 59.237 1.55857 112.5 3.8 3.7 5.8
60 1 7 -1 29.825 59.65 1.54876 51.7 1.8 1.7 5.8
61 2 6 -1 30.101 60.201 1.53589 93.1 3.2 3.1 5.8
62 0 3 3 30.15 60.3 1.53362 120.6 4.1 4.0 5.8
63 0 6 2 30.195 60.39 1.53154 112.8 3.9 3.7 5.8
64 1 4 -3 30.264 60.529 1.52836 98.7 3.4 3.3 5.8
65 3 2 0 30.491 60.982 1.51808 500.1 17.1 16.5 5.8
66 3 3 -2 30.823 61.646 1.50332 507.8 17.4 16.8 5.8
67 2 6 0 30.985 61.971 1.49621 38.9 1.3 1.3 5.8
68 1 5 2 31.199 62.398 1.48699 88.4 3.0 2.9 5.8
69 2 0 2 31.654 63.309 1.46777 30.3 1.0 1.0 5.9
70 2 5 1 31.782 63.564 1.46249 105.2 3.6 3.5 5.9
71 2 4 -3 31.836 63.671 1.46029 546.7 18.7 18.0 5.9
72 2 1 2 31.936 63.872 1.45618 223.4 7.6 7.3 5.9
73 0 8 0 32.054 64.109 1.45137 34.4 1.2 1.1 5.9
74 1 7 1 32.235 64.47 1.44412 255.6 8.7 8.4 5.9
75 2 6 -2 32.283 64.566 1.4422 31.1 1.1 1.0 5.9
76 3 1 -3 32.567 65.135 1.43098 223.9 7.7 7.3 5.9
77 2 2 2 32.773 65.545 1.423 35.4 1.2 1.2 5.9
78 1 7 -2 33.19 66.381 1.4071 148.9 5.1 4.9 5.9
79 0 8 1 33.541 67.082 1.39408 61.9 2.1 2.0 5.9
80 1 8 0 33.729 67.458 1.38723 129.5 4.4 4.2 5.9
81 3 4 0 33.85 67.7 1.38286 57.8 2.0 1.9 5.9
82 1 2 3 33.996 67.992 1.37762 335.1 11.5 10.9 5.9
83 1 8 -1 34.042 68.084 1.376 79.9 2.7 2.6 5.9
84 2 3 2 34.143 68.287 1.3724 44.7 1.5 1.5 5.9
85 1 6 2 34.25 68.5 1.36864 36.2 1.2 1.2 5.9
86 3 5 -1 34.314 68.628 1.3664 341.2 11.7 11.1 5.9
87 2 7 0 34.588 69.176 1.3569 131.6 4.5 4.3 5.9
88 3 1 1 34.671 69.342 1.35407 48.3 1.7 1.6 5.9
89 3 3 -3 34.754 69.508 1.35124 47.2 1.6 1.5 5.9
90 2 6 1 34.806 69.612 1.34947 180.4 6.2 5.9 5.9
91 3 5 -2 35.242 70.483 1.33492 59.6 2.0 1.9 5.9
92 3 2 1 35.475 70.951 1.32726 69.2 2.4 2.2 5.9
93 2 7 -2 35.818 71.636 1.31623 226.4 7.7 7.3 5.9
94 2 4 2 36.02 72.04 1.30984 44.7 1.5 1.4 5.9
95 1 2 -4 36.152 72.305 1.30571 214.7 7.3 7.0 5.9
96 3 4 -3 36.617 73.234 1.29141 84.9 2.9 2.7 6.0
97 1 8 -2 37.209 74.418 1.27378 35.5 1.2 1.1 6.0
98 1 3 -4 37.467 74.933 1.26629 103.3 3.5 3.3 6.0
99 0 6 3 37.53 75.06 1.26446 102.8 3.5 3.3 6.0
100 4 0 -2 37.604 75.207 1.26235 35.1 1.2 1.1 6.0
101 2 8 -1 37.747 75.493 1.25828 66.1 2.3 2.1 6.0
102 2 3 -4 37.802 75.604 1.25671 80.2 2.7 2.6 6.0
103 4 1 -2 37.864 75.728 1.25496 40.4 1.4 1.3 6.0
104 0 0 4 37.942 75.884 1.25276 41.4 1.4 1.3 6.0
105 4 1 -1 38.065 76.131 1.24932 81.7 2.8 2.6 6.0
106 3 6 -2 38.137 76.275 1.24731 37.5 1.3 1.2 6.0
107 2 7 1 38.235 76.471 1.24461 33.0 1.1 1.1 6.0
108 2 5 2 38.377 76.754 1.24071 106.5 3.6 3.4 6.0
109 2 8 0 38.544 77.088 1.23618 62.3 2.1 2.0 6.0
110 4 2 -2 38.642 77.284 1.23353 29.4 1.0 0.9 6.0
111 4 2 -1 38.842 77.684 1.22817 68.6 2.3 2.2 6.0
112 0 2 4 38.978 77.955 1.22457 60.8 2.1 1.9 6.0
113 3 6 0 39.132 78.263 1.22053 38.6 1.3 1.2 6.0
114 3 1 -4 39.199 78.397 1.21878 109.5 3.7 3.5 6.0
115 1 4 -4 39.28 78.561 1.21665 48.3 1.7 1.5 6.0
116 4 3 -1 40.127 80.253 1.1952 39.4 1.3 1.3 6.0
117 2 6 2 41.199 82.397 1.16944 45.4 1.6 1.4 6.1
118 1 5 -4 41.58 83.159 1.16066 66.8 2.3 2.1 6.1
119 2 8 1 42.075 84.151 1.14948 41.3 1.4 1.3 6.1
120 1 6 3 42.33 84.66 1.14387 33.9 1.2 1.1 6.1
121 4 3 -3 42.464 84.928 1.14094 32.7 1.1 1.0 6.1
122 3 2 2 42.902 85.804 1.13152 92.9 3.2 2.9 6.1
123 3 4 -4 43.019 86.038 1.12904 83.8 2.9 2.6 6.1
124 1 10 0 43.094 86.188 1.12747 50.1 1.7 1.6 6.1
125 1 10 -1 43.384 86.768 1.12141 43.6 1.5 1.4 6.1
126 4 5 -1 44.185 88.369 1.10518 41.9 1.4 1.3 6.2
127 3 8 -1 44.394 88.789 1.10104 31.0 1.1 1.0 6.2
128 2 6 -4 44.686 89.371 1.09537 61.9 2.1 1.9 6.2
129 1 2 4 44.806 89.611 1.09305 79.3 2.7 2.5 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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