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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SARCOPSIDE
4, SSS, Ni, Co, analogue
[Ni(0.65)Co(0.35)](3)[PO(4)](2)
Monoclinic P 2(1)/a Z = 2
R =0.056 NR =80
7 .9 .1990
Ref.Str.:
Nord A.G. (1984)
* Z. Kristallogr., 166, 159-176
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 10.185 alpha = 90.0
b = 4.713 beta = 91.09
c = 5.865 gamma = 90.0
Unit cell volume (cub. angs.) = 281.48
Molar volume ( cub.cm/mol.) = 84.77
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.0 0.5 1.4 Ni = 0.74, Co = 0.26
2 0.279 0.994 0.244 1.4 Ni = 0.61, Co = 0.4
3 0.087 0.428 0.254 0.7 P = 1.00
4 0.1 0.75 0.277 0.9 O = 1.00
5 0.458 0.194 0.261 0.9 O = 1.00
6 0.176 0.313 0.05 0.9 O = 1.00
7 0.156 0.273 0.463 0.9 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.0 0.5
2 2 0.279 0.994 0.244
3 3 0.087 0.428 0.254
4 4 0.1 0.75 0.277
5 5 0.458 0.194 0.261
6 6 0.176 0.313 0.05
7 7 0.156 0.273 0.463
8 2 0.721 0.006 0.756
9 3 0.913 0.572 0.746
10 4 0.9 0.25 0.723
11 5 0.542 0.806 0.739
12 6 0.824 0.687 0.95
13 7 0.844 0.727 0.537
14 1 0.5 0.5 0.5
15 2 0.779 0.506 0.244
16 3 0.587 0.072 0.254
17 4 0.6 0.75 0.277
18 5 0.958 0.306 0.261
19 6 0.676 0.187 0.05
20 7 0.656 0.227 0.463
21 2 0.221 0.494 0.756
22 3 0.413 0.928 0.746
23 4 0.4 0.25 0.723
24 5 0.042 0.694 0.739
25 6 0.324 0.813 0.95
26 7 0.344 0.773 0.537
X-ray density (g/cm cub.) = 4.32
MU (1/cm) = 916.94 Mass attenuation coefficient (cm**2/g) = 212.242
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ni ,Co 2.568 6
2.0462 4
2.0592 7
2.0462 4
2.0592 7
2.0506 5
2.0506 5
2 Ni ,Co 2.568 6
2.1673 4
2.0531 5
2.1471 6
2.2382 7
1.9852 6
2.1055 7
3 P 2.232 4
1.5291 4
1.6088 6
1.5803 7
1.4355 5
4 O 3.264 11
3.0743 6
2.5793 6
2.7509 7
2.5584 7
3.0474 7
2.9937 5
2.5444 5
2.7967 5
3.21 5
3.0229 6
2.8929 7
5 O 3.264 9
3.156 6
2.9937 4
2.5444 4
2.5626 6
2.3246 7
2.7967 4
3.21 4
2.8843 6
2.8243 7
6 O 3.264 9
2.5793 4
3.0743 4
3.156 5
2.4419 7
2.5626 5
3.0229 4
2.8843 5
2.8641 6
2.8641 6
7 O 3.264 9
2.5584 4
2.7509 4
2.4419 6
3.0474 4
2.3246 5
2.8929 4
2.8243 5
3.0621 7
3.0621 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 0 1 7.548 15.096 0.085 112.96 2 51.7 762.1
2 2 0 0 8.701 17.403 0.098 84.45 2 8.5 15.5
3 1 1 0 10.375 20.75 0.117 58.75 4 27.9 231.2
4 2 0 -1 11.447 22.894 0.129 47.89 2 16.1 31.2
5 2 0 1 11.668 23.335 0.131 46.02 2 92.0 983.1
6 0 1 1 12.104 24.208 0.136 42.61 4 30.5 199.8
7 1 1 -1 12.83 25.66 0.144 37.7 4 14.5 40.2
8 2 1 0 12.868 25.736 0.145 37.46 4 25.6 123.9
9 1 1 1 12.93 25.859 0.145 37.09 4 98.9 1830.6
10 2 1 -1 14.898 29.796 0.167 27.45 4 18.0 45.1
11 2 1 1 15.071 30.142 0.169 26.77 4 17.4 41.1
12 0 0 2 15.231 30.463 0.171 26.17 2 88.2 513.9
13 3 1 0 16.24 32.479 0.182 22.8 4 85.9 848.7
14 2 0 -2 17.497 34.994 0.195 19.38 2 33.2 53.9
15 4 0 0 17.612 35.224 0.196 19.11 2 37.3 67.2
16 2 0 2 17.797 35.594 0.198 18.68 2 49.0 113.4
17 3 1 -1 17.886 35.773 0.199 18.47 4 122.4 1397.4
18 0 1 2 18.023 36.047 0.201 18.17 4 5.5 2.8
19 3 1 1 18.107 36.215 0.202 17.98 4 63.0 360.6
20 1 1 -2 18.502 37.003 0.206 17.15 4 84.9 624.1
21 1 1 2 18.645 37.29 0.208 16.86 4 79.1 532.7
22 0 2 0 19.079 38.158 0.212 16.03 2 57.5 133.9
23 4 0 -1 19.12 38.241 0.213 15.95 2 42.0 71.1
24 4 0 1 19.399 38.797 0.216 15.45 2 84.4 277.7
25 1 2 0 19.604 39.207 0.218 15.09 4 35.8 97.7
26 2 1 -2 20.012 40.023 0.222 14.42 4 43.9 140.1
27 4 1 0 20.114 40.228 0.223 14.25 4 48.1 166.2
28 2 1 2 20.28 40.559 0.225 14.0 4 36.3 93.3
29 0 2 1 20.627 41.254 0.229 13.48 4 22.0 33.1
30 1 2 -1 21.087 42.174 0.234 12.83 4 32.2 67.3
31 2 2 0 21.112 42.223 0.234 12.79 4 21.1 28.8
32 1 2 1 21.151 42.303 0.234 12.74 4 46.8 140.8
33 4 1 -1 21.473 42.946 0.238 12.32 4 8.7 4.7
34 4 1 1 21.726 43.453 0.24 12.0 4 7.4 3.3
35 3 1 -2 22.379 44.759 0.247 11.22 4 7.1 2.8
36 2 2 -1 22.483 44.965 0.248 11.11 4 51.3 147.6
37 2 2 1 22.605 45.21 0.25 10.97 4 12.3 8.3
38 3 1 2 22.746 45.492 0.251 10.82 4 11.1 6.7
39 0 0 3 23.208 46.417 0.256 10.34 2 26.3 18.1
40 4 0 -2 23.386 46.771 0.258 10.16 2 8.8 2.0
41 3 2 0 23.448 46.897 0.258 10.1 4 15.1 11.6
42 4 0 2 23.858 47.715 0.263 9.71 2 0.4 0.0
43 5 1 0 24.331 48.663 0.267 9.29 4 5.2 1.3
44 3 2 -1 24.689 49.378 0.271 8.98 4 6.6 2.0
45 0 2 2 24.795 49.589 0.272 8.9 4 46.5 97.1
46 2 0 -3 24.798 49.596 0.272 8.89 2 12.7 3.6
47 3 2 1 24.86 49.719 0.273 8.84 4 0.1 0.0
48 2 0 3 25.138 50.275 0.276 8.62 2 22.7 11.2
49 1 2 -2 25.166 50.332 0.276 8.6 4 3.0 0.4
50 0 1 3 25.253 50.507 0.277 8.53 4 9.2 3.7
51 1 2 2 25.279 50.557 0.277 8.51 4 4.5 0.9
52 4 1 -2 25.42 50.84 0.279 8.41 4 8.0 2.7
53 5 1 -1 25.484 50.968 0.279 8.36 4 4.9 1.0
54 1 1 -3 25.592 51.185 0.28 8.28 4 79.8 266.2
55 1 1 3 25.759 51.518 0.282 8.16 4 16.0 10.6
56 5 1 1 25.762 51.523 0.282 8.15 4 65.8 178.2
57 4 1 2 25.864 51.728 0.283 8.08 4 12.9 6.8
58 2 2 -2 26.367 52.734 0.288 7.73 4 100.3 392.5
59 4 2 0 26.45 52.9 0.289 7.68 4 79.5 245.1
60 2 2 2 26.584 53.168 0.29 7.59 4 94.0 338.7
61 2 1 -3 26.753 53.505 0.292 7.48 4 15.7 9.3
62 6 0 0 26.991 53.983 0.295 7.33 2 14.9 4.1
63 2 1 3 27.075 54.149 0.295 7.28 4 39.5 57.3
64 4 2 -1 27.565 55.13 0.3 6.99 4 25.5 22.9
65 4 2 1 27.775 55.551 0.302 6.87 4 94.2 307.9
66 6 0 -1 28.039 56.078 0.305 6.72 2 101.4 174.4
67 3 2 -2 28.323 56.646 0.308 6.57 4 11.4 4.3
68 6 0 1 28.351 56.703 0.308 6.56 2 50.3 41.8
69 3 2 2 28.633 57.266 0.311 6.41 4 21.2 14.5
70 3 1 -3 28.665 57.33 0.311 6.4 4 42.8 59.0
71 6 1 0 28.841 57.683 0.313 6.31 4 6.3 1.3
72 5 1 -2 28.997 57.994 0.315 6.23 4 42.3 56.4
73 3 1 3 29.126 58.252 0.316 6.17 4 99.0 305.2
74 4 0 -3 29.488 58.977 0.32 6.0 2 103.9 163.4
75 5 1 2 29.505 59.01 0.32 5.99 4 34.3 35.6
76 1 3 0 29.743 59.486 0.322 5.89 4 31.7 29.9
77 6 1 -1 29.846 59.693 0.323 5.84 4 4.4 0.6
78 5 2 0 29.993 59.986 0.324 5.78 4 7.1 1.5
79 4 0 3 30.091 60.183 0.325 5.73 2 42.0 25.5
80 6 1 1 30.147 60.293 0.326 5.71 4 13.6 5.4
81 0 3 1 30.504 61.009 0.329 5.56 4 27.6 21.4
82 0 2 3 30.797 61.594 0.332 5.45 4 33.6 31.0
83 1 3 -1 30.853 61.706 0.333 5.42 4 23.0 14.4
84 2 3 0 30.872 61.744 0.333 5.42 4 30.2 24.9
85 1 3 1 30.902 61.805 0.333 5.4 4 70.3 134.8
86 4 2 -2 30.943 61.887 0.334 5.39 4 8.8 2.1
87 5 2 -1 31.0 61.999 0.334 5.37 4 19.0 9.8
88 1 2 -3 31.095 62.19 0.335 5.33 4 26.4 18.7
89 1 2 3 31.242 62.484 0.337 5.28 4 21.0 11.8
90 4 1 -3 31.243 62.486 0.337 5.28 4 10.1 2.7
91 5 2 1 31.244 62.489 0.337 5.28 4 23.2 14.3
92 4 2 2 31.335 62.67 0.338 5.24 4 0.1 0.0
93 6 0 -2 31.337 62.673 0.338 5.24 2 115.8 177.3
94 0 0 4 31.698 63.395 0.341 5.11 2 138.0 245.8
95 4 1 3 31.826 63.653 0.342 5.07 4 19.4 9.7
96 6 0 2 31.919 63.838 0.343 5.03 2 101.4 130.6
97 2 3 -1 31.935 63.87 0.343 5.03 4 15.4 6.0
98 2 3 1 32.031 64.062 0.344 5.0 4 23.3 13.7
99 2 2 -3 32.124 64.248 0.345 4.96 4 29.8 22.2
100 2 2 3 32.412 64.824 0.348 4.87 4 14.9 5.5
101 3 3 0 32.703 65.405 0.351 4.78 4 39.4 37.4
102 2 0 -4 32.957 65.914 0.353 4.7 2 13.7 2.2
103 6 1 -2 33.034 66.069 0.354 4.67 4 5.2 0.6
104 2 0 4 33.335 66.671 0.357 4.59 2 8.6 0.9
105 0 1 4 33.385 66.771 0.357 4.57 4 2.0 0.1
106 6 1 2 33.601 67.201 0.359 4.51 4 2.5 0.1
107 1 1 -4 33.647 67.295 0.36 4.5 4 24.1 13.2
108 7 1 0 33.652 67.304 0.36 4.49 4 86.8 171.1
109 3 3 -1 33.711 67.421 0.36 4.48 4 81.3 149.5
110 0 3 2 33.798 67.595 0.361 4.45 4 2.8 0.2
111 1 1 4 33.835 67.67 0.361 4.44 4 2.7 0.2
112 3 2 -3 33.848 67.696 0.362 4.44 4 14.2 4.5
113 3 3 1 33.851 67.702 0.362 4.44 4 24.7 13.6
114 6 2 0 34.008 68.017 0.363 4.4 4 25.1 14.0
115 1 3 -2 34.105 68.209 0.364 4.37 4 40.6 36.3
116 5 2 -2 34.15 68.301 0.364 4.36 4 15.7 5.4
117 1 3 2 34.198 68.396 0.365 4.35 4 24.8 13.5
118 3 2 3 34.268 68.536 0.365 4.33 4 14.9 4.8
119 5 1 -3 34.412 68.824 0.367 4.29 4 35.4 27.2
120 7 1 -1 34.554 69.107 0.368 4.25 4 14.2 4.3
121 2 1 -4 34.613 69.226 0.369 4.24 4 9.0 1.7
122 5 2 2 34.615 69.23 0.369 4.24 4 7.6 1.2
123 7 1 1 34.877 69.755 0.371 4.17 4 26.5 14.8
124 6 2 -1 34.929 69.857 0.372 4.16 4 46.9 46.3
125 2 1 4 34.983 69.965 0.372 4.15 4 5.1 0.6
126 5 1 3 35.106 70.211 0.373 4.12 4 1.7 0.1
127 2 3 -2 35.11 70.221 0.373 4.12 4 51.0 54.1
128 4 3 0 35.181 70.361 0.374 4.1 4 43.5 39.3
129 6 2 1 35.205 70.41 0.374 4.1 4 4.3 0.4
130 2 3 2 35.294 70.589 0.375 4.08 4 53.0 57.8
131 4 3 -1 36.133 72.266 0.383 3.89 4 24.3 11.6
132 4 2 -3 36.22 72.441 0.384 3.87 4 59.6 69.4
133 3 1 -4 36.256 72.513 0.384 3.87 4 48.9 46.7
134 4 3 1 36.315 72.629 0.384 3.85 4 34.7 23.4
135 6 0 -3 36.54 73.079 0.386 3.81 2 30.7 9.1
136 4 2 3 36.764 73.528 0.389 3.76 4 6.5 0.8
137 3 3 -2 36.79 73.579 0.389 3.76 4 22.7 9.8
138 3 1 4 36.8 73.6 0.389 3.76 4 39.2 29.1
139 4 0 -4 36.964 73.929 0.39 3.73 2 23.3 5.1
140 3 3 2 37.06 74.12 0.391 3.71 4 16.8 5.3
141 8 0 0 37.239 74.478 0.393 3.68 2 4.5 0.2
142 6 0 3 37.351 74.703 0.394 3.66 2 82.9 63.4
143 7 1 -2 37.513 75.026 0.395 3.63 4 44.9 36.9
144 4 0 4 37.683 75.366 0.397 3.6 2 30.8 8.6
145 6 2 -2 37.898 75.796 0.399 3.56 4 24.4 10.7
146 8 0 -1 38.082 76.164 0.4 3.53 2 29.9 8.0
147 6 1 -3 38.127 76.254 0.401 3.52 4 11.9 2.5
148 7 1 2 38.139 76.278 0.401 3.52 4 35.9 22.9
149 0 2 4 38.229 76.459 0.402 3.51 4 52.2 48.3
150 5 3 0 38.26 76.52 0.402 3.5 4 4.4 0.3
151 6 2 2 38.433 76.866 0.403 3.47 4 42.0 31.0
152 8 0 1 38.438 76.876 0.404 3.47 2 26.5 6.1
153 1 2 -4 38.477 76.955 0.404 3.47 4 10.5 1.9
154 7 2 0 38.482 76.964 0.404 3.47 4 12.2 2.6
155 4 1 -4 38.545 77.09 0.404 3.46 4 20.6 7.4
156 1 2 4 38.655 77.31 0.405 3.44 4 21.6 8.1
157 8 1 0 38.816 77.632 0.407 3.42 4 4.0 0.3
158 6 1 3 38.927 77.854 0.408 3.4 4 23.1 9.1
159 0 3 3 38.98 77.96 0.408 3.39 4 35.8 21.9
160 4 3 -2 39.112 78.223 0.409 3.37 4 21.7 8.0
161 5 3 -1 39.162 78.324 0.41 3.37 4 5.4 0.5
162 5 2 -3 39.203 78.407 0.41 3.36 4 26.8 12.2
163 1 3 -3 39.248 78.497 0.411 3.35 4 39.6 26.6
164 4 1 4 39.254 78.509 0.411 3.35 4 1.7 0.1
165 7 2 -1 39.338 78.676 0.411 3.34 4 21.0 7.5
166 1 3 3 39.381 78.762 0.412 3.34 4 6.5 0.7
167 5 3 1 39.383 78.766 0.412 3.34 4 24.5 10.1
168 2 2 -4 39.395 78.789 0.412 3.33 4 13.4 3.0
169 4 3 2 39.465 78.93 0.413 3.32 4 18.9 6.0
170 7 2 1 39.647 79.294 0.414 3.3 4 8.9 1.3
171 8 1 -1 39.648 79.297 0.414 3.3 4 8.8 1.3
172 2 2 4 39.748 79.495 0.415 3.29 4 13.9 3.2
173 5 2 3 39.865 79.73 0.416 3.27 4 23.3 9.0
174 8 1 1 40.001 80.001 0.417 3.25 4 20.0 6.6
175 2 3 -3 40.183 80.366 0.419 3.23 4 22.0 7.9
176 2 3 3 40.446 80.893 0.421 3.2 4 0.6 0.0
177 0 4 0 40.825 81.65 0.424 3.16 2 67.9 36.7
178 8 0 -2 40.928 81.856 0.425 3.15 2 25.9 5.3
179 3 2 -4 40.97 81.939 0.426 3.14 4 17.8 5.0
180 0 0 5 41.056 82.112 0.426 3.13 2 29.2 6.8
181 1 4 0 41.156 82.312 0.427 3.12 4 8.4 1.1
182 5 1 -4 41.455 82.909 0.43 3.09 4 7.9 1.0
183 3 2 4 41.494 82.988 0.43 3.09 4 10.9 1.8
184 8 0 2 41.627 83.254 0.431 3.07 2 11.7 1.1
185 3 3 -3 41.773 83.546 0.432 3.06 4 19.9 6.1
186 0 4 1 41.822 83.644 0.433 3.05 4 26.0 10.4
187 6 3 0 41.922 83.845 0.434 3.05 4 1.2 0.0
188 5 3 -2 42.055 84.11 0.435 3.03 4 45.3 31.5
189 1 4 -1 42.13 84.259 0.435 3.03 4 14.2 3.1
190 2 4 0 42.146 84.293 0.436 3.02 4 16.5 4.2
191 2 0 -5 42.158 84.317 0.436 3.02 2 1.2 0.0
192 3 3 3 42.165 84.33 0.436 3.02 4 61.1 56.9
193 1 4 1 42.173 84.346 0.436 3.02 4 6.0 0.5
194 7 2 -2 42.185 84.369 0.436 3.02 4 25.7 10.0
195 5 1 4 42.326 84.652 0.437 3.01 4 12.1 2.2
196 7 1 -3 42.386 84.772 0.438 3.0 4 30.4 14.0
197 8 1 -2 42.469 84.937 0.438 3.0 4 25.7 10.0
198 5 3 2 42.49 84.98 0.438 3.0 4 42.6 27.5
199 2 0 5 42.593 85.187 0.439 2.99 2 56.2 23.8
200 0 1 5 42.596 85.192 0.439 2.99 4 29.1 12.8
201 6 2 -3 42.782 85.564 0.441 2.97 4 11.1 1.9
202 6 3 -1 42.785 85.57 0.441 2.97 4 30.1 13.6
203 7 2 2 42.794 85.587 0.441 2.97 4 26.6 10.6
204 1 1 -5 42.816 85.632 0.441 2.97 4 3.3 0.2
205 1 1 5 43.033 86.067 0.443 2.95 4 32.5 15.7
206 6 3 1 43.045 86.091 0.443 2.95 4 36.9 20.3
207 2 4 -1 43.095 86.19 0.443 2.95 4 24.3 8.8
208 8 1 2 43.164 86.328 0.444 2.94 4 20.4 6.2
209 2 4 1 43.182 86.363 0.444 2.94 4 7.9 0.9
210 4 2 -4 43.19 86.38 0.444 2.94 4 37.1 20.4
211 7 1 3 43.298 86.596 0.445 2.93 4 7.7 0.9
212 6 0 -4 43.452 86.904 0.446 2.92 2 18.0 2.4
213 8 2 0 43.455 86.909 0.446 2.92 4 21.6 6.9
214 6 2 3 43.563 87.126 0.447 2.91 4 31.5 14.6
215 2 1 -5 43.693 87.386 0.448 2.9 4 0.1 0.0
216 3 4 0 43.79 87.58 0.449 2.9 4 27.5 11.1
217 4 2 4 43.884 87.768 0.45 2.89 4 42.0 25.7
218 4 3 -3 44.009 88.019 0.451 2.88 4 27.5 11.0
219 2 1 5 44.127 88.253 0.452 2.88 4 6.6 0.6
220 8 2 -1 44.271 88.541 0.453 2.87 4 18.0 4.7
221 9 1 0 44.437 88.874 0.454 2.86 4 15.0 3.2
222 6 0 4 44.492 88.985 0.455 2.86 2 25.9 4.8
223 4 3 3 44.529 89.059 0.455 2.85 4 32.5 15.2
224 8 2 1 44.617 89.235 0.456 2.85 4 39.8 22.8
225 3 4 -1 44.714 89.428 0.457 2.84 4 2.6 0.1
226 0 4 2 44.794 89.588 0.457 2.84 4 13.1 2.5
227 3 4 1 44.844 89.688 0.458 2.84 4 0.3 0.0
228 6 1 -4 44.983 89.966 0.459 2.83 4 9.5 1.3
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 7.548 15.096 5.86394 762.1 41.6 41.9 5.6
2 1 1 0 10.375 20.75 4.27712 231.2 12.6 12.7 5.6
3 2 0 -1 11.447 22.894 3.88129 31.2 1.7 1.7 5.6
4 2 0 1 11.668 23.335 3.80886 983.1 53.7 53.8 5.6
5 0 1 1 12.104 24.208 3.67355 199.8 10.9 10.9 5.6
6 1 1 -1 12.83 25.66 3.46879 40.2 2.2 2.2 5.6
7 2 1 0 12.868 25.736 3.4587 123.9 6.8 6.8 5.6
8 1 1 1 12.93 25.859 3.4425 1830.6 100.0 100.0 5.6
9 2 1 -1 14.898 29.796 2.99609 45.1 2.5 2.5 5.6
10 2 1 1 15.071 30.142 2.96239 41.1 2.2 2.2 5.6
11 0 0 2 15.231 30.463 2.93197 513.9 28.1 28.0 5.6
12 3 1 0 16.24 32.479 2.75438 848.7 46.4 46.1 5.6
13 2 0 -2 17.497 34.994 2.56198 53.9 2.9 2.9 5.7
14 4 0 0 17.612 35.224 2.54579 67.2 3.7 3.6 5.7
15 2 0 2 17.797 35.594 2.52017 113.4 6.2 6.1 5.7
16 3 1 -1 17.886 35.773 2.50799 1397.4 76.3 75.7 5.7
17 3 1 1 18.107 36.215 2.47837 360.6 19.7 19.5 5.7
18 1 1 -2 18.502 37.003 2.42738 624.1 34.1 33.8 5.7
19 1 1 2 18.645 37.29 2.40936 532.7 29.1 28.8 5.7
20 0 2 0 19.079 38.158 2.3565 133.9 7.3 7.2 5.7
21 4 0 -1 19.12 38.241 2.35161 71.1 3.9 3.8 5.7
22 4 0 1 19.399 38.797 2.31915 277.7 15.2 15.0 5.7
23 1 2 0 19.604 39.207 2.29583 97.7 5.3 5.3 5.7
24 2 1 -2 20.012 40.023 2.2509 140.1 7.7 7.6 5.7
25 4 1 0 20.114 40.228 2.2399 166.2 9.1 9.0 5.7
26 2 1 2 20.28 40.559 2.22239 93.3 5.1 5.0 5.7
27 0 2 1 20.627 41.254 2.18655 33.1 1.8 1.8 5.7
28 1 2 -1 21.087 42.174 2.14094 96.2 5.3 5.2 5.7
29 1 2 1 21.151 42.303 2.13471 140.8 7.7 7.6 5.7
30 2 2 -1 22.483 44.965 2.01431 147.6 8.1 7.9 5.7
31 0 2 2 24.795 49.589 1.83677 100.8 5.5 5.4 5.7
32 1 1 -3 25.592 51.185 1.78319 266.2 14.5 14.2 5.8
33 5 1 1 25.762 51.523 1.77227 188.8 10.3 10.1 5.8
34 2 2 -2 26.367 52.734 1.7344 392.5 21.4 20.9 5.8
35 4 2 0 26.45 52.9 1.72935 245.1 13.4 13.0 5.8
36 2 2 2 26.584 53.168 1.72125 338.7 18.5 18.0 5.8
37 2 1 3 27.075 54.149 1.69236 57.3 3.1 3.0 5.8
38 4 2 -1 27.565 55.13 1.66457 22.9 1.3 1.2 5.8
39 4 2 1 27.775 55.551 1.65293 307.9 16.8 16.3 5.8
40 6 0 -1 28.039 56.078 1.63863 174.4 9.5 9.2 5.8
41 6 0 1 28.351 56.703 1.62206 46.1 2.5 2.4 5.8
42 3 1 -3 28.665 57.33 1.60579 59.0 3.2 3.1 5.8
43 5 1 -2 28.997 57.994 1.58898 56.4 3.1 3.0 5.8
44 3 1 3 29.126 58.252 1.58256 305.2 16.7 16.1 5.8
45 4 0 -3 29.488 58.977 1.56482 199.0 10.9 10.5 5.8
46 1 3 0 29.743 59.486 1.55263 29.9 1.6 1.6 5.8
47 4 0 3 30.091 60.183 1.53632 25.5 1.4 1.3 5.8
48 0 3 1 30.504 61.009 1.51749 21.4 1.2 1.1 5.8
49 0 2 3 30.797 61.594 1.50446 31.0 1.7 1.6 5.8
50 2 3 0 30.872 61.744 1.50117 39.3 2.1 2.1 5.8
51 1 3 1 30.902 61.805 1.49984 134.8 7.4 7.1 5.8
52 1 2 -3 31.095 62.19 1.49146 18.7 1.0 1.0 5.8
53 5 2 1 31.244 62.489 1.48505 28.8 1.6 1.5 5.8
54 6 0 -2 31.337 62.673 1.48112 177.3 9.7 9.3 5.8
55 0 0 4 31.698 63.395 1.46598 245.8 13.4 12.9 5.9
56 6 0 2 31.919 63.838 1.45689 136.6 7.5 7.1 5.9
57 2 2 -3 32.124 64.248 1.44857 22.2 1.2 1.2 5.9
58 3 3 0 32.703 65.405 1.42571 37.4 2.0 2.0 5.9
59 7 1 0 33.652 67.304 1.39003 184.3 10.1 9.6 5.9
60 3 3 -1 33.711 67.421 1.3879 149.5 8.2 7.8 5.9
61 1 3 -2 34.105 68.209 1.37377 36.3 2.0 1.9 5.9
62 5 1 -3 34.412 68.824 1.36299 27.2 1.5 1.4 5.9
63 6 2 -1 34.929 69.857 1.34534 46.3 2.5 2.4 5.9
64 2 3 -2 35.11 70.221 1.33926 54.1 3.0 2.8 5.9
65 4 3 0 35.181 70.361 1.33693 39.7 2.2 2.1 5.9
66 2 3 2 35.294 70.589 1.33318 57.8 3.2 3.0 5.9
67 4 2 -3 36.22 72.441 1.30358 69.4 3.8 3.6 5.9
68 3 1 -4 36.256 72.513 1.30247 46.7 2.5 2.4 5.9
69 4 3 1 36.315 72.629 1.30067 23.4 1.3 1.2 6.0
70 3 1 4 36.8 73.6 1.2859 38.9 2.1 2.0 6.0
71 6 0 3 37.351 74.703 1.26962 63.4 3.5 3.3 6.0
72 7 1 -2 37.513 75.026 1.26495 36.9 2.0 1.9 6.0
73 7 1 2 38.139 76.278 1.24728 25.4 1.4 1.3 6.0
74 0 2 4 38.229 76.459 1.24477 48.3 2.6 2.5 6.0
75 6 2 2 38.433 76.866 1.23919 37.1 2.0 1.9 6.0
76 0 3 3 38.98 77.96 1.22452 21.9 1.2 1.1 6.0
77 1 3 -3 39.248 78.497 1.21748 26.6 1.5 1.4 6.0
78 0 4 0 40.825 81.65 1.17825 36.7 2.0 1.9 6.1
79 5 3 -2 42.055 84.11 1.14994 31.5 1.7 1.6 6.1
80 3 3 3 42.165 84.33 1.1475 74.8 4.1 3.8 6.1
81 5 3 2 42.49 84.98 1.14037 37.5 2.0 1.9 6.1
82 2 0 5 42.593 85.187 1.13814 36.6 2.0 1.8 6.1
83 7 2 2 42.794 85.587 1.13383 26.1 1.4 1.3 6.1
84 6 3 1 43.045 86.091 1.12849 36.0 2.0 1.8 6.1
85 4 2 -4 43.19 86.38 1.12545 27.5 1.5 1.4 6.1
86 4 2 4 43.884 87.768 1.11119 25.7 1.4 1.3 6.2
87 8 2 1 44.617 89.235 1.09669 22.8 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)
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