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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TANGEITE
1, td-descloizite
CaCu[VO(4)](OH)
Orthorhombic P 2(1)2(1)2(1) Z = 4
P2(1)2(1)2(1)
28 .3 .1994
Ref.Str.:
M.M. Qurashi, W.H. Barnes (1964)
* Canad. Mineral., 8, 23-39
Ref.Composition & Lattice:
Povarennyh A.S. (1966)
* Kristallohim. klassif. miner. vidov (in russian), 385-386
Reserv:
The coordinates of atoms are from descloisite. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 7.44 alpha = 90.0
b = 5.9 beta = 90.0
c = 9.24 gamma = 90.0
Unit cell volume (cub. angs.) = 405.6
Molar volume ( cub.cm/mol.) = 61.08
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.128 0.253 0.426 0.0 Ca = 1.00
2 0.0 0.003 0.75 0.0 Cu = 1.00
3 0.367 0.754 0.565 0.0 V = 1.00
4 0.196 0.735 0.67 0.0 O = 1.00
5 0.54 0.774 0.668 0.0 O = 1.00
6 0.38 0.516 0.456 0.0 O = 1.00
7 0.379 0.987 0.447 0.0 O = 1.00
8 0.142 0.26 0.691 0.0 OH = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.128 0.253 0.426
2 2 0.0 0.003 0.75
3 3 0.367 0.754 0.565
4 4 0.196 0.735 0.67
5 5 0.54 0.774 0.668
6 6 0.38 0.516 0.456
7 7 0.379 0.987 0.447
8 8 0.142 0.26 0.691
9 1 0.372 0.747 0.926
10 2 0.5 0.997 0.25
11 3 0.133 0.246 0.065
12 4 0.304 0.265 0.17
13 5 0.96 0.226 0.168
14 6 0.12 0.484 0.956
15 7 0.121 0.013 0.947
16 8 0.358 0.74 0.191
17 1 0.872 0.753 0.074
18 2 0.0 0.503 0.75
19 3 0.633 0.254 0.935
20 4 0.804 0.235 0.83
21 5 0.46 0.274 0.832
22 6 0.62 0.016 0.044
23 7 0.621 0.487 0.053
24 8 0.858 0.76 0.809
25 1 0.628 0.247 0.574
26 2 0.5 0.497 0.25
27 3 0.867 0.746 0.435
28 4 0.696 0.765 0.33
29 5 0.04 0.726 0.332
30 6 0.88 0.984 0.544
31 7 0.879 0.513 0.553
32 8 0.642 0.24 0.309
X-ray density (g/cm cub.) = 3.86
MU (1/cm) = 370.887 Mass attenuation coefficient (cm**2/g) = 96.172
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca 2.928 7
2.4494 6
2.447 7
2.4512 8
2.7046 4
2.6964 5
2.6669 6
2.6762 7
2 Cu 2.856 6
2.2744 4
1.9268 8
2.0316 7
2.1323 4
1.8625 8
2.1054 6
3 V 2.544 4
1.6039 4
1.6051 5
1.7308 6
1.7569 7
4 O 3.312 10
2.5697 5
2.7301 6
2.8827 7
3.1295 8
2.8378 8
3.0816 6
3.0907 7
2.8276 8
3.0068 6
2.9063 7
5 O 3.312 6
2.5697 4
2.7516 6
2.6803 7
2.7022 8
3.0408 6
3.1403 7
6 O 3.312 10
2.7301 4
2.7516 5
2.7802 7
3.1222 7
3.183 8
3.0816 4
2.7873 8
3.0068 4
3.0408 5
2.8803 8
7 O 3.312 10
2.8827 4
2.6803 5
3.1222 6
2.7802 6
3.2843 8
3.0907 4
2.7827 8
2.9063 4
3.1403 5
2.7718 8
8 OH 3.36 10
2.8378 4
3.1295 4
3.183 6
3.2843 7
2.7873 6
2.7827 7
2.8276 4
2.7022 5
2.8803 6
2.7718 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 1 0 1 7.639 15.277 0.086 110.25 4 76.3 1559.1
2 0 1 1 8.911 17.822 0.101 80.42 4 23.3 106.1
3 1 1 0 9.592 19.183 0.108 69.11 4 4.5 3.4
4 0 0 2 9.598 19.195 0.108 69.02 2 17.2 24.9
5 1 1 1 10.738 21.476 0.121 54.71 8 38.0 383.3
6 1 0 2 11.318 22.636 0.127 49.03 4 6.6 5.2
7 2 0 0 11.95 23.901 0.134 43.77 2 90.1 432.0
8 0 1 2 12.226 24.451 0.137 41.73 4 0.1 0.0
9 2 0 1 12.898 25.796 0.145 37.28 4 29.2 77.1
10 1 1 2 13.634 27.268 0.153 33.15 8 19.7 62.3
11 2 1 0 14.169 28.338 0.159 30.55 4 129.8 1251.3
12 2 1 1 14.987 29.973 0.168 27.1 8 0.4 0.0
13 0 2 0 15.136 30.272 0.169 26.53 2 54.6 96.0
14 2 0 2 15.417 30.834 0.173 25.5 4 96.4 575.8
15 1 0 3 15.704 31.409 0.176 24.51 4 156.9 1466.5
16 0 2 1 15.908 31.816 0.178 23.83 4 1.8 0.2
17 1 2 0 16.313 32.626 0.182 22.57 4 10.0 5.5
18 0 1 3 16.387 32.773 0.183 22.36 4 12.2 8.1
19 1 2 1 17.038 34.075 0.19 20.54 8 138.2 1907.5
20 2 1 2 17.228 34.456 0.192 20.05 8 79.0 609.2
21 1 1 3 17.489 34.977 0.195 19.4 8 90.8 777.5
22 0 2 2 18.047 36.095 0.201 18.11 4 95.1 398.3
23 3 0 1 18.759 37.518 0.209 16.64 4 74.3 223.2
24 2 0 3 18.947 37.893 0.211 16.27 4 81.1 260.3
25 1 2 2 19.065 38.13 0.212 16.05 8 41.8 136.3
26 2 2 0 19.466 38.932 0.216 15.33 4 105.5 414.6
27 0 0 4 19.479 38.957 0.216 15.31 2 69.0 88.7
28 3 1 0 19.689 39.379 0.219 14.95 4 1.8 0.1
29 2 2 1 20.091 40.183 0.223 14.29 8 52.6 192.4
30 3 1 1 20.309 40.618 0.225 13.95 8 2.1 0.3
31 1 0 4 20.436 40.872 0.227 13.76 4 49.7 82.7
32 2 1 3 20.484 40.969 0.227 13.69 8 7.8 4.1
33 3 0 2 20.641 41.283 0.229 13.46 4 36.7 44.0
34 0 1 4 20.984 41.967 0.232 12.97 4 1.2 0.0
35 0 2 3 21.196 42.392 0.235 12.68 4 3.4 0.4
36 2 2 2 21.878 43.756 0.242 11.81 8 84.9 414.1
37 1 1 4 21.886 43.773 0.242 11.8 8 21.9 27.4
38 3 1 2 22.081 44.162 0.244 11.57 8 13.1 9.6
39 1 2 3 22.092 44.183 0.244 11.55 8 13.5 10.3
40 2 0 4 23.111 46.222 0.255 10.44 4 88.0 196.5
41 3 0 3 23.501 47.002 0.259 10.05 4 15.3 5.7
42 0 3 1 23.606 47.212 0.26 9.95 4 7.4 1.3
43 1 3 0 23.899 47.797 0.263 9.67 4 8.8 1.8
44 3 2 0 23.939 47.879 0.263 9.63 4 5.9 0.8
45 1 3 1 24.432 48.863 0.268 9.2 8 35.0 54.7
46 2 1 4 24.435 48.87 0.269 9.2 8 7.5 2.5
47 4 0 0 24.464 48.929 0.269 9.17 2 60.4 40.6
48 3 2 1 24.472 48.944 0.269 9.16 8 83.8 312.9
49 2 2 3 24.624 49.247 0.27 9.04 8 24.3 25.9
50 3 1 3 24.809 49.618 0.272 8.88 8 68.0 200.1
51 4 0 1 24.988 49.977 0.274 8.74 4 0.5 0.0
52 0 2 4 25.057 50.114 0.275 8.68 4 130.3 358.7
53 0 3 2 25.194 50.387 0.276 8.58 4 7.4 1.1
54 1 0 5 25.435 50.87 0.279 8.39 4 58.4 69.7
55 4 1 0 25.736 51.471 0.282 8.17 4 19.5 7.6
56 1 2 4 25.849 51.697 0.283 8.09 8 4.8 0.9
57 0 1 5 25.899 51.798 0.284 8.06 4 11.5 2.6
58 1 3 2 25.982 51.964 0.284 8.0 8 20.4 16.1
59 3 2 2 26.02 52.04 0.285 7.97 8 5.4 1.1
60 4 1 1 26.241 52.482 0.287 7.82 8 4.6 0.8
61 2 3 0 26.298 52.595 0.288 7.78 4 94.6 169.2
62 4 0 2 26.515 53.03 0.29 7.64 4 174.7 566.8
63 1 1 5 26.672 53.345 0.291 7.53 8 54.9 110.6
64 2 3 1 26.796 53.591 0.293 7.45 8 4.4 0.7
65 3 0 4 27.11 54.22 0.296 7.26 4 11.7 2.4
66 0 3 3 27.691 55.382 0.302 6.92 4 11.4 2.2
67 4 1 2 27.719 55.437 0.302 6.9 8 6.0 1.2
68 2 0 5 27.737 55.474 0.302 6.89 4 16.0 4.3
69 2 2 4 28.127 56.254 0.306 6.68 8 84.5 232.0
70 2 3 2 28.253 56.506 0.307 6.61 8 56.3 101.7
71 3 1 4 28.296 56.593 0.308 6.59 8 16.3 8.5
72 1 3 3 28.431 56.862 0.309 6.52 8 81.1 208.3
73 3 2 3 28.467 56.934 0.309 6.5 8 182.2 1048.5
74 2 1 5 28.907 57.813 0.314 6.28 8 4.6 0.7
75 4 0 3 28.933 57.866 0.314 6.26 4 8.8 1.2
76 4 2 0 29.313 58.625 0.318 6.08 4 153.1 346.5
77 0 2 5 29.462 58.925 0.319 6.01 4 3.5 0.2
78 4 2 1 29.777 59.553 0.322 5.87 8 7.4 1.6
79 3 3 0 29.992 59.983 0.324 5.78 4 3.0 0.1
80 0 0 6 30.012 60.024 0.325 5.77 2 133.1 124.3
81 4 1 3 30.072 60.145 0.325 5.74 8 35.0 34.1
82 1 2 5 30.174 60.348 0.326 5.7 8 152.0 640.6
83 3 3 1 30.449 60.899 0.329 5.59 8 8.3 1.9
84 2 3 3 30.58 61.161 0.33 5.53 8 5.4 0.8
85 1 0 6 30.716 61.432 0.332 5.48 4 4.7 0.3
86 0 3 4 30.957 61.913 0.334 5.38 4 8.5 0.9
87 0 1 6 31.127 62.254 0.336 5.32 4 1.6 0.0
88 4 2 2 31.144 62.287 0.336 5.31 8 46.6 56.0
89 3 0 5 31.32 62.64 0.337 5.25 4 145.6 270.3
90 0 4 0 31.482 62.963 0.339 5.19 2 242.8 371.9
91 5 0 1 31.623 63.246 0.34 5.14 4 101.1 127.7
92 1 3 4 31.648 63.297 0.341 5.13 8 7.5 1.4
93 3 2 4 31.682 63.364 0.341 5.12 8 31.2 24.2
94 3 3 2 31.799 63.599 0.342 5.08 8 4.6 0.5
95 1 1 6 31.817 63.634 0.342 5.07 8 17.7 7.7
96 0 4 1 31.927 63.854 0.343 5.03 4 12.3 1.9
97 4 0 4 32.12 64.239 0.345 4.97 4 78.9 75.2
98 1 4 0 32.167 64.334 0.346 4.95 4 3.3 0.1
99 2 2 5 32.253 64.506 0.346 4.92 8 17.9 7.7
100 5 1 0 32.267 64.535 0.347 4.92 4 1.8 0.0
101 3 1 5 32.409 64.818 0.348 4.87 8 62.3 92.0
102 1 4 1 32.607 65.214 0.35 4.81 8 59.2 81.8
103 5 1 1 32.707 65.414 0.351 4.78 8 32.4 24.3
104 2 0 6 32.775 65.551 0.351 4.75 4 73.6 62.7
105 5 0 2 32.946 65.892 0.353 4.7 4 17.1 3.3
106 4 1 4 33.195 66.389 0.355 4.63 8 2.6 0.1
107 0 4 2 33.243 66.486 0.356 4.61 4 19.1 4.1
108 4 2 3 33.35 66.7 0.357 4.58 8 12.2 3.3
109 2 3 4 33.676 67.353 0.36 4.49 8 13.5 4.0
110 2 1 6 33.84 67.679 0.361 4.44 8 85.9 159.4
111 1 4 2 33.91 67.819 0.362 4.42 8 7.9 1.3
112 3 3 3 33.983 67.966 0.363 4.4 8 63.4 86.0
113 5 1 2 34.007 68.015 0.363 4.4 8 5.4 0.6
114 2 4 0 34.179 68.358 0.365 4.35 4 68.8 50.1
115 0 2 6 34.349 68.698 0.366 4.31 4 39.6 16.4
116 2 4 1 34.606 69.212 0.369 4.24 8 24.1 12.0
117 4 3 0 34.751 69.501 0.37 4.21 4 16.8 2.9
118 0 3 5 34.887 69.774 0.371 4.17 4 7.7 0.6
119 1 2 6 35.006 70.011 0.372 4.14 8 39.1 30.8
120 5 0 3 35.093 70.186 0.373 4.12 4 42.2 17.8
121 4 3 1 35.175 70.349 0.374 4.1 8 12.6 3.2
122 0 4 3 35.382 70.763 0.376 4.06 4 5.8 0.3
123 5 2 0 35.436 70.871 0.376 4.04 4 7.1 0.5
124 1 3 5 35.539 71.078 0.377 4.02 8 54.5 58.1
125 3 2 5 35.571 71.142 0.378 4.01 8 18.0 6.3
126 5 2 1 35.856 71.712 0.38 3.95 8 43.0 35.6
127 2 4 2 35.873 71.747 0.38 3.95 8 76.0 110.9
128 4 0 5 35.985 71.97 0.381 3.92 4 9.1 0.8
129 1 4 3 36.03 72.059 0.382 3.91 8 123.0 288.0
130 3 0 6 36.07 72.14 0.382 3.9 4 6.9 0.4
131 5 1 3 36.125 72.249 0.383 3.89 8 74.2 104.1
132 4 2 4 36.324 72.647 0.385 3.85 8 56.9 60.6
133 1 0 7 36.346 72.692 0.385 3.85 4 65.3 39.9
134 4 3 2 36.433 72.867 0.386 3.83 8 7.0 0.9
135 0 1 7 36.725 73.45 0.388 3.77 4 10.9 1.1
136 3 3 4 36.933 73.867 0.39 3.73 8 18.6 6.3
137 2 2 6 36.944 73.887 0.39 3.73 8 78.9 113.0
138 4 1 5 37.006 74.012 0.391 3.72 8 9.4 1.6
139 3 1 6 37.09 74.181 0.391 3.7 8 19.8 7.1
140 5 2 2 37.105 74.211 0.392 3.7 8 32.4 18.8
141 1 1 7 37.363 74.727 0.394 3.65 8 6.1 0.7
142 3 4 0 37.417 74.834 0.394 3.64 4 3.6 0.1
143 2 3 5 37.466 74.932 0.395 3.64 8 3.7 0.2
144 3 4 1 37.829 75.657 0.398 3.57 8 72.2 90.5
145 2 4 3 37.947 75.894 0.399 3.55 8 45.3 35.4
146 5 0 4 38.007 76.015 0.4 3.54 4 27.0 6.3
147 2 0 7 38.257 76.515 0.402 3.5 4 16.4 2.3
148 0 4 4 38.287 76.575 0.402 3.5 4 57.6 28.2
149 6 0 0 38.403 76.807 0.403 3.48 2 100.3 42.6
150 4 3 3 38.496 76.991 0.404 3.46 8 22.3 8.4
151 6 0 1 38.812 77.623 0.407 3.42 4 35.0 10.2
152 1 4 4 38.917 77.834 0.408 3.4 8 25.6 10.8
153 5 1 4 39.01 78.019 0.409 3.39 8 13.2 2.9
154 3 4 2 39.055 78.11 0.409 3.38 8 18.4 5.6
155 5 2 3 39.155 78.311 0.41 3.37 8 134.1 294.4
156 2 1 7 39.258 78.515 0.411 3.35 8 4.4 0.3
157 6 1 0 39.403 78.805 0.412 3.33 4 116.3 109.7
158 0 3 6 39.441 78.882 0.412 3.33 4 0.2 0.0
159 0 2 7 39.74 79.479 0.415 3.29 4 6.6 0.4
160 6 1 1 39.808 79.616 0.416 3.28 8 8.4 1.1
161 4 2 5 40.014 80.028 0.417 3.25 8 9.4 1.4
162 6 0 2 40.029 80.059 0.417 3.25 4 71.0 39.8
163 1 3 6 40.066 80.131 0.418 3.25 8 20.2 6.5
164 3 2 6 40.096 80.193 0.418 3.24 8 27.7 12.1
165 1 2 7 40.363 80.726 0.42 3.21 8 52.1 42.4
166 5 3 0 40.476 80.953 0.421 3.2 4 3.1 0.1
167 4 0 6 40.494 80.989 0.422 3.19 4 7.3 0.4
168 3 3 5 40.606 81.212 0.422 3.18 8 59.1 54.0
169 2 4 4 40.79 81.58 0.424 3.16 8 71.5 78.7
170 5 3 1 40.879 81.758 0.425 3.15 8 29.2 13.0
171 6 1 2 41.018 82.036 0.426 3.14 8 35.6 19.3
172 3 4 3 41.076 82.153 0.427 3.13 8 14.5 3.2
173 0 5 1 41.154 82.307 0.427 3.12 4 20.6 3.2
174 4 3 4 41.329 82.657 0.429 3.1 8 10.0 1.5
175 1 5 0 41.372 82.743 0.429 3.1 4 7.6 0.4
176 3 0 7 41.38 82.761 0.429 3.1 4 100.3 75.8
177 4 1 6 41.481 82.961 0.43 3.09 8 8.2 1.0
178 5 0 5 41.653 83.305 0.431 3.07 4 84.3 53.0
179 1 5 1 41.773 83.545 0.432 3.06 8 24.5 8.9
180 4 4 0 41.797 83.595 0.433 3.06 4 34.8 9.0
181 0 0 8 41.829 83.658 0.433 3.05 2 46.9 8.2
182 0 4 5 41.926 83.852 0.434 3.05 4 3.5 0.1
183 2 3 6 41.927 83.853 0.434 3.05 8 72.7 78.2
184 5 2 4 41.977 83.955 0.434 3.04 8 1.8 0.0
185 6 0 3 42.04 84.08 0.435 3.03 4 7.8 0.5
186 5 3 2 42.083 84.166 0.435 3.03 8 7.6 0.9
187 4 4 1 42.198 84.396 0.436 3.02 8 4.7 0.3
188 2 2 7 42.221 84.443 0.436 3.02 8 10.5 1.6
189 0 5 2 42.356 84.712 0.437 3.01 4 5.6 0.2
190 3 1 7 42.363 84.726 0.437 3.01 8 14.0 2.8
191 6 2 0 42.364 84.728 0.437 3.01 4 36.0 9.5
192 1 0 8 42.446 84.892 0.438 3.0 4 5.5 0.2
193 1 4 5 42.543 85.086 0.439 2.99 8 41.6 25.1
194 5 1 5 42.634 85.268 0.44 2.98 8 46.5 31.3
195 6 2 1 42.764 85.528 0.441 2.97 8 9.5 1.3
196 0 1 8 42.81 85.62 0.441 2.97 4 3.9 0.1
197 1 5 2 42.972 85.944 0.442 2.96 8 7.8 0.9
198 6 1 3 43.02 86.04 0.443 2.95 8 3.8 0.2
199 2 5 0 43.223 86.445 0.445 2.94 4 89.4 57.1
200 4 4 2 43.396 86.792 0.446 2.92 8 132.0 247.7
201 1 1 8 43.425 86.851 0.446 2.92 8 14.3 2.9
202 2 5 1 43.621 87.243 0.448 2.91 8 3.0 0.1
203 3 4 4 43.876 87.751 0.45 2.89 8 10.0 1.4
204 6 2 2 43.96 87.921 0.451 2.89 8 74.2 77.2
205 5 3 3 44.079 88.157 0.452 2.88 8 69.5 67.6
206 2 0 8 44.292 88.584 0.453 2.87 4 74.1 38.3
207 0 5 3 44.351 88.701 0.454 2.86 4 5.4 0.2
208 2 4 5 44.389 88.777 0.454 2.86 8 8.7 1.1
209 4 2 6 44.419 88.838 0.454 2.86 8 130.1 235.5
210 0 3 7 44.652 89.304 0.456 2.85 4 12.5 1.1
211 2 5 2 44.816 89.633 0.458 2.84 8 56.3 43.8
212 6 0 4 44.832 89.665 0.458 2.84 4 61.9 26.4
213 4 3 5 44.922 89.845 0.458 2.83 8 8.6 1.0
214 1 5 3 44.965 89.93 0.459 2.83 8 53.7 39.8
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 1 0 1 7.639 15.277 5.79495 1559.1 81.7 82.9 5.6
2 0 1 1 8.911 17.822 4.97272 106.1 5.6 5.6 5.6
3 0 0 2 9.598 19.195 4.62 28.3 1.5 1.5 5.6
4 1 1 1 10.738 21.476 4.13429 383.3 20.1 20.3 5.6
5 2 0 0 11.95 23.901 3.72 432.0 22.6 22.8 5.6
6 2 0 1 12.898 25.796 3.45083 77.1 4.0 4.1 5.6
7 1 1 2 13.634 27.268 3.26784 62.3 3.3 3.3 5.6
8 2 1 0 14.169 28.338 3.14674 1251.3 65.6 65.9 5.6
9 0 2 0 15.136 30.272 2.95 96.0 5.0 5.1 5.6
10 2 0 2 15.417 30.834 2.89748 575.8 30.2 30.3 5.6
11 1 0 3 15.704 31.409 2.84579 1466.5 76.9 77.1 5.6
12 1 2 1 17.038 34.075 2.62896 1907.5 100.0 100.0 5.7
13 2 1 2 17.228 34.456 2.60078 609.2 31.9 31.9 5.7
14 1 1 3 17.489 34.977 2.5632 777.5 40.8 40.7 5.7
15 0 2 2 18.047 36.095 2.48636 398.3 20.9 20.8 5.7
16 3 0 1 18.759 37.518 2.39523 223.2 11.7 11.7 5.7
17 2 0 3 18.947 37.893 2.37238 260.3 13.6 13.6 5.7
18 1 2 2 19.065 38.13 2.35816 136.3 7.1 7.1 5.7
19 2 2 0 19.466 38.932 2.31142 503.2 26.4 26.3 5.7
20 2 2 1 20.091 40.183 2.24233 192.4 10.1 10.0 5.7
21 1 0 4 20.436 40.872 2.20611 82.7 4.3 4.3 5.7
22 3 0 2 20.641 41.283 2.18509 44.0 2.3 2.3 5.7
23 2 2 2 21.878 43.756 2.06714 441.5 23.1 22.9 5.7
24 1 2 3 22.092 44.183 2.04813 19.9 1.0 1.0 5.7
25 2 0 4 23.111 46.222 1.96242 196.5 10.3 10.2 5.7
26 1 3 1 24.432 48.863 1.86234 57.2 3.0 3.0 5.7
27 3 2 1 24.472 48.944 1.85948 353.5 18.5 18.3 5.7
28 2 2 3 24.624 49.247 1.84873 25.9 1.4 1.3 5.7
29 3 1 3 24.809 49.618 1.83577 200.1 10.5 10.3 5.7
30 0 2 4 25.057 50.114 1.81875 358.7 18.8 18.5 5.7
31 1 0 5 25.435 50.87 1.7935 69.7 3.7 3.6 5.8
32 2 3 0 26.298 52.595 1.73865 169.2 8.9 8.7 5.8
33 4 0 2 26.515 53.03 1.72542 566.8 29.7 29.1 5.8
34 1 1 5 26.672 53.345 1.71597 110.6 5.8 5.7 5.8
35 2 2 4 28.127 56.254 1.63392 232.0 12.2 11.9 5.8
36 2 3 2 28.253 56.506 1.62723 101.7 5.3 5.2 5.8
37 1 3 3 28.431 56.862 1.61791 208.3 10.9 10.6 5.8
38 3 2 3 28.467 56.934 1.61603 1048.5 55.0 53.6 5.8
39 4 2 0 29.313 58.625 1.57337 346.5 18.2 17.7 5.8
40 0 0 6 30.012 60.024 1.54 124.3 6.5 6.3 5.8
41 4 1 3 30.072 60.145 1.5372 34.1 1.8 1.7 5.8
42 1 2 5 30.174 60.348 1.5325 640.6 33.6 32.6 5.8
43 4 2 2 31.144 62.287 1.48937 56.0 2.9 2.8 5.8
44 3 0 5 31.32 62.64 1.48183 270.3 14.2 13.7 5.8
45 0 4 0 31.482 62.963 1.475 371.9 19.5 18.8 5.9
46 5 0 1 31.623 63.246 1.46907 129.1 6.8 6.5 5.9
47 3 2 4 31.682 63.364 1.46662 24.2 1.3 1.2 5.9
48 4 0 4 32.12 64.239 1.44874 75.2 3.9 3.8 5.9
49 3 1 5 32.409 64.818 1.4372 92.0 4.8 4.6 5.9
50 1 4 1 32.607 65.214 1.42942 81.8 4.3 4.1 5.9
51 5 1 1 32.707 65.414 1.42555 24.3 1.3 1.2 5.9
52 2 0 6 32.775 65.551 1.42289 62.7 3.3 3.2 5.9
53 2 1 6 33.84 67.679 1.38324 159.4 8.4 8.0 5.9
54 3 3 3 33.983 67.966 1.3781 86.7 4.5 4.4 5.9
55 2 4 0 34.179 68.358 1.37115 50.1 2.6 2.5 5.9
56 1 2 6 35.006 70.011 1.34276 30.8 1.6 1.5 5.9
57 1 3 5 35.539 71.078 1.3252 58.1 3.0 2.9 5.9
58 2 4 2 35.873 71.747 1.31448 146.5 7.7 7.3 5.9
59 1 4 3 36.03 72.059 1.30955 288.0 15.1 14.4 5.9
60 5 1 3 36.125 72.249 1.30657 104.1 5.5 5.2 5.9
61 4 2 4 36.324 72.647 1.30039 100.5 5.3 5.0 6.0
62 2 2 6 36.944 73.887 1.2816 119.2 6.3 5.9 6.0
63 5 2 2 37.105 74.211 1.27681 25.9 1.4 1.3 6.0
64 3 4 1 37.829 75.657 1.25596 90.5 4.7 4.5 6.0
65 2 4 3 37.947 75.894 1.25263 35.4 1.9 1.8 6.0
66 0 4 4 38.287 76.575 1.24318 30.5 1.6 1.5 6.0
67 6 0 0 38.403 76.807 1.24 42.6 2.2 2.1 6.0
68 5 2 3 39.155 78.311 1.21991 294.4 15.4 14.5 6.0
69 6 1 0 39.403 78.805 1.21349 109.7 5.7 5.4 6.0
70 6 0 2 40.029 80.059 1.19761 41.2 2.2 2.0 6.0
71 1 2 7 40.363 80.726 1.18938 42.4 2.2 2.1 6.1
72 3 3 5 40.606 81.212 1.18349 54.0 2.8 2.6 6.1
73 2 4 4 40.79 81.58 1.17908 78.7 4.1 3.8 6.1
74 6 1 2 41.018 82.036 1.17368 19.3 1.0 0.9 6.1
75 3 0 7 41.38 82.761 1.16523 75.8 4.0 3.7 6.1
76 5 0 5 41.653 83.305 1.15899 53.0 2.8 2.6 6.1
77 2 3 6 41.927 83.853 1.15281 78.2 4.1 3.8 6.1
78 1 4 5 42.543 85.086 1.13922 25.1 1.3 1.2 6.1
79 5 1 5 42.634 85.268 1.13726 31.3 1.6 1.5 6.1
80 2 5 0 43.223 86.445 1.12477 57.1 3.0 2.8 6.1
81 4 4 2 43.396 86.792 1.12116 250.6 13.1 12.1 6.1
82 6 2 2 43.96 87.921 1.10966 77.2 4.0 3.7 6.2
83 5 3 3 44.079 88.157 1.10729 67.6 3.5 3.3 6.2
84 2 0 8 44.292 88.584 1.10306 38.3 2.0 1.8 6.2
85 4 2 6 44.419 88.838 1.10055 236.5 12.4 11.3 6.2
86 2 5 2 44.816 89.633 1.09285 70.2 3.7 3.4 6.2
87 1 5 3 44.965 89.93 1.09001 39.8 2.1 1.9 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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