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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DIOPSIDE
5, t-diopside, at 400'C, f-pyroxenes, sf-Ca-Na-pyroxenes, s-diopside
CaMgSi(2)O(6)
Monoclinic C 2/c Z = 4
R =0.075 NR =733
26 .6 .1990
Ref.Str.:
M.Cameron, S.Sueno, C.T.Prewitt (1973)
* Amer. Mineral., 58, 594-618
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 9.776 alpha = 90.0
b = 8.979 beta = 105.94
c = 5.267 gamma = 90.0
Unit cell volume (cub. angs.) = 444.55
Molar volume ( cub.cm/mol.) = 66.94
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.116 0.0868 0.1424 1.05 O = 1.00
2 0.3611 0.2486 0.3163 1.39 O = 1.00
3 0.3501 0.0165 0.9961 1.22 O = 1.00
4 0.2862 0.0929 0.2294 0.8 Si = 1.00
5 0.0 0.9072 0.25 0.96 Mg = 1.00
6 0.0 0.3008 0.25 1.41 Ca = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.116 0.0868 0.1424
2 2 0.3611 0.2486 0.3163
3 3 0.3501 0.0165 0.9961
4 4 0.2862 0.0929 0.2294
5 5 0.0 0.9072 0.25
6 6 0.0 0.3008 0.25
7 1 0.884 0.9132 0.8576
8 2 0.6389 0.7514 0.6837
9 3 0.6499 0.9835 0.0039
10 4 0.7138 0.9071 0.7706
11 5 0.0 0.0928 0.75
12 6 0.0 0.6992 0.75
13 1 0.116 0.9132 0.6424
14 2 0.3611 0.7514 0.8163
15 3 0.3501 0.9835 0.4961
16 4 0.2862 0.9071 0.7294
17 1 0.884 0.0868 0.3576
18 2 0.6389 0.2486 0.1837
19 3 0.6499 0.0165 0.5039
20 4 0.7138 0.0929 0.2706
21 1 0.616 0.4132 0.6424
22 2 0.8611 0.2514 0.8163
23 3 0.8501 0.4835 0.4961
24 4 0.7862 0.4071 0.7294
25 5 0.5 0.5928 0.75
26 6 0.5 0.1992 0.75
27 1 0.384 0.5868 0.3576
28 2 0.1389 0.7486 0.1837
29 3 0.1499 0.5165 0.5039
30 4 0.2138 0.5929 0.2706
31 5 0.5 0.4072 0.25
32 6 0.5 0.8008 0.25
33 1 0.616 0.5868 0.1424
34 2 0.8611 0.7486 0.3163
35 3 0.8501 0.5165 0.9961
36 4 0.7862 0.5929 0.2294
37 1 0.384 0.4132 0.8576
38 2 0.1389 0.2514 0.6837
39 3 0.1499 0.4835 0.0039
40 4 0.2138 0.4071 0.7706
X-ray density (g/cm cub.) = 3.23
MU (1/cm) = 178.326 Mass attenuation coefficient (cm**2/g) = 55.133
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 O 3.264 11
2.7359 2
2.683 3
2.8205 1
3.0602 1
3.0602 1
2.6882 3
2.8001 1
2.9988 2
3.0483 2
3.1642 2
2.8928 2
2 O 3.264 9
2.7359 1
2.6645 3
2.5749 3
2.9841 2
2.9988 1
3.0483 1
3.1642 1
2.8928 1
3.0908 3
3 O 3.264 8
2.683 1
2.6645 2
2.9348 3
2.6882 1
2.5749 2
2.6501 3
2.6501 3
3.0908 2
4 Si 2.1 4
1.6008 1
1.5862 2
1.671 3
1.6871 3
5 Mg 2.52 6
2.1356 1
2.0671 1
2.0671 1
2.1356 1
2.0626 2
2.0626 2
6 Ca 2.88 8
2.3775 1
2.3775 1
2.3569 2
2.7499 3
2.5711 3
2.5711 3
2.3569 2
2.7499 3
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 1 0 6.813 13.627 0.077 139.14 4 2.7 2.0
2 2 0 0 9.433 18.865 0.106 71.54 2 2.6 0.5
3 0 2 0 9.879 19.759 0.111 65.02 2 24.0 37.8
4 1 1 -1 10.035 20.069 0.113 62.96 4 8.2 8.5
5 1 1 1 12.116 24.231 0.136 42.52 4 19.5 32.8
6 0 2 1 13.255 26.51 0.149 35.19 4 43.0 131.9
7 2 2 0 13.725 27.451 0.154 32.68 4 68.9 314.4
8 2 2 -1 14.856 29.712 0.166 27.61 4 147.2 1210.5
9 3 1 0 15.092 30.184 0.169 26.69 4 77.0 320.5
10 3 1 -1 15.385 30.771 0.172 25.61 4 90.7 426.6
11 1 3 0 15.67 31.339 0.175 24.62 4 17.3 14.9
12 1 3 -1 17.381 34.762 0.194 19.67 4 84.6 284.9
13 2 0 -2 17.658 35.315 0.197 19.0 2 35.0 23.6
14 0 0 2 17.709 35.419 0.197 18.88 2 160.3 490.7
15 1 1 -2 17.747 35.494 0.198 18.79 4 10.0 3.8
16 2 2 1 17.768 35.535 0.198 18.74 4 112.9 483.9
17 1 3 1 18.713 37.425 0.208 16.73 4 18.3 11.4
18 4 0 0 19.134 38.268 0.213 15.93 2 20.7 6.9
19 3 1 1 19.503 39.006 0.217 15.27 4 80.1 198.4
20 0 4 0 20.069 40.137 0.223 14.33 2 5.2 0.4
21 3 1 -2 20.202 40.403 0.224 14.12 4 7.8 1.7
22 1 1 2 20.294 40.588 0.225 13.97 4 61.7 107.6
23 2 2 -2 20.395 40.79 0.226 13.82 4 24.8 17.3
24 0 2 2 20.441 40.882 0.227 13.75 4 61.9 106.7
25 3 3 0 20.849 41.698 0.231 13.16 4 63.7 108.1
26 3 3 -1 21.071 42.143 0.233 12.85 4 88.6 204.2
27 4 2 -1 21.357 42.714 0.236 12.47 4 61.8 96.3
28 4 2 0 21.713 43.427 0.24 12.01 4 22.6 12.4
29 0 4 1 22.046 44.091 0.244 11.61 4 97.4 222.8
30 2 4 0 22.351 44.701 0.247 11.25 4 17.2 6.7
31 4 0 -2 22.399 44.798 0.247 11.2 2 108.9 134.4
32 2 0 2 22.526 45.053 0.249 11.06 2 83.1 77.3
33 1 3 -2 22.93 45.859 0.253 10.62 4 62.3 83.4
34 2 4 -1 23.11 46.219 0.255 10.44 4 18.8 7.5
35 5 1 -1 23.9 47.799 0.263 9.67 4 13.1 3.3
36 3 3 1 24.376 48.751 0.268 9.25 4 36.3 24.6
37 4 2 -2 24.702 49.404 0.271 8.97 4 17.8 5.8
38 5 1 0 24.746 49.493 0.272 8.94 4 65.0 76.4
39 2 2 2 24.82 49.641 0.272 8.87 4 44.0 34.8
40 3 3 -2 24.964 49.928 0.274 8.76 4 5.4 0.5
41 1 3 2 25.042 50.084 0.275 8.7 4 48.0 40.5
42 2 4 1 25.211 50.422 0.276 8.56 4 16.4 4.7
43 4 2 1 25.651 51.301 0.281 8.23 4 25.2 10.6
44 1 5 0 25.893 51.786 0.283 8.06 4 97.6 155.3
45 5 1 -2 26.515 53.03 0.29 7.64 4 37.0 21.2
46 3 1 2 26.665 53.33 0.291 7.54 4 20.6 6.5
47 1 1 -3 26.689 53.378 0.292 7.52 4 8.6 1.1
48 1 5 -1 27.062 54.124 0.295 7.29 4 30.5 13.7
49 2 4 -2 27.258 54.515 0.297 7.17 4 24.9 9.0
50 0 4 2 27.294 54.589 0.298 7.15 4 60.8 53.5
51 3 1 -3 27.581 55.163 0.301 6.98 4 71.1 71.4
52 1 5 1 28.019 56.038 0.305 6.74 4 10.6 1.5
53 4 4 -1 28.037 56.074 0.305 6.73 4 15.4 3.2
54 5 3 -1 28.18 56.359 0.307 6.65 4 110.3 163.8
55 2 2 -3 28.208 56.416 0.307 6.63 4 119.3 191.0
56 4 4 0 28.329 56.659 0.308 6.57 4 64.9 56.1
57 5 1 1 28.834 57.668 0.313 6.31 4 3.1 0.1
58 5 3 0 28.937 57.873 0.314 6.26 4 40.2 20.5
59 0 2 3 29.175 58.35 0.316 6.15 4 7.3 0.7
60 6 0 0 29.45 58.9 0.319 6.02 2 81.1 40.1
61 1 1 3 29.522 59.043 0.32 5.99 4 5.3 0.3
62 3 5 0 29.629 59.259 0.321 5.94 4 65.3 51.3
63 3 5 -1 29.802 59.604 0.323 5.86 4 14.1 2.3
64 6 0 -2 30.14 60.28 0.326 5.71 2 97.2 54.7
65 6 2 -1 30.213 60.426 0.327 5.68 4 47.0 25.4
66 4 0 2 30.312 60.624 0.328 5.64 2 111.4 70.8
67 5 3 -2 30.538 61.076 0.33 5.55 4 36.5 15.0
68 3 3 2 30.675 61.35 0.331 5.49 4 2.5 0.1
69 1 3 -3 30.697 61.394 0.331 5.49 4 114.1 144.6
70 4 2 -3 30.848 61.696 0.333 5.43 4 24.0 6.3
71 4 4 -2 30.85 61.7 0.333 5.43 4 5.9 0.4
72 2 4 2 30.952 61.904 0.334 5.39 4 42.6 19.8
73 0 6 0 30.979 61.958 0.334 5.38 2 97.4 51.6
74 1 5 -2 31.277 62.553 0.337 5.26 4 10.6 1.2
75 6 2 0 31.382 62.764 0.338 5.22 4 21.8 5.0
76 3 3 -3 31.516 63.032 0.339 5.18 4 24.3 6.2
77 4 4 1 31.673 63.346 0.341 5.12 4 42.0 18.3
78 5 1 -3 31.995 63.991 0.344 5.01 4 21.3 4.6
79 6 2 -2 32.047 64.094 0.344 4.99 4 51.9 27.2
80 4 2 2 32.213 64.427 0.346 4.93 4 38.5 14.8
81 0 6 1 32.461 64.922 0.348 4.85 4 48.2 22.9
82 3 5 1 32.462 64.924 0.348 4.85 4 18.5 3.3
83 5 3 1 32.675 65.35 0.35 4.79 4 142.1 195.6
84 2 6 0 32.696 65.392 0.351 4.78 4 32.9 10.5
85 3 5 -2 32.953 65.905 0.353 4.7 4 103.8 102.4
86 1 5 2 33.018 66.036 0.354 4.68 4 70.2 46.7
87 2 6 -1 33.288 66.577 0.356 4.6 4 5.5 0.3
88 1 3 3 33.316 66.632 0.357 4.59 4 14.0 1.8
89 2 2 3 33.558 67.116 0.359 4.52 4 73.2 49.0
90 7 1 -1 33.932 67.864 0.362 4.42 4 39.4 13.9
91 2 4 -3 33.94 67.881 0.362 4.41 4 37.0 12.3
92 0 4 3 34.814 69.628 0.371 4.19 4 45.5 17.6
93 2 6 1 34.977 69.955 0.372 4.15 4 20.1 3.4
94 7 1 -2 35.249 70.498 0.375 4.09 4 93.2 71.9
95 6 2 1 35.388 70.777 0.376 4.05 4 72.9 43.7
96 5 1 2 35.439 70.879 0.376 4.04 4 38.2 11.9
97 7 1 0 35.45 70.899 0.376 4.04 4 40.8 13.6
98 3 1 3 35.523 71.046 0.377 4.02 4 35.2 10.1
99 5 3 -3 35.645 71.291 0.378 4.0 4 67.9 37.3
100 5 5 -1 35.714 71.429 0.379 3.98 4 11.7 1.1
101 6 4 -1 35.762 71.523 0.379 3.97 4 12.9 1.3
102 2 0 -4 35.803 71.605 0.38 3.96 2 10.5 0.4
103 4 4 -3 36.345 72.691 0.385 3.85 4 34.7 9.4
104 5 5 0 36.382 72.765 0.385 3.84 4 10.1 0.8
105 3 1 -4 36.617 73.234 0.387 3.79 4 72.9 40.9
106 6 2 -3 36.639 73.279 0.387 3.79 4 9.4 0.7
107 1 1 -4 36.68 73.359 0.388 3.78 4 53.5 21.9
108 2 6 -2 36.687 73.375 0.388 3.78 4 70.2 37.7
109 0 6 2 36.719 73.437 0.388 3.77 4 94.1 67.6
110 6 4 0 36.839 73.678 0.389 3.75 4 31.5 7.5
111 1 7 0 37.306 74.612 0.393 3.66 4 0.9 0.0
112 4 0 -4 37.348 74.696 0.394 3.66 2 70.0 18.1
113 4 6 -1 37.354 74.707 0.394 3.66 4 37.6 10.4
114 6 4 -2 37.457 74.914 0.395 3.64 4 13.1 1.3
115 0 0 4 37.472 74.945 0.395 3.63 2 100.2 37.0
116 7 3 -1 37.493 74.986 0.395 3.63 4 47.1 16.3
117 2 2 -4 37.563 75.126 0.396 3.62 4 19.2 2.7
118 4 6 0 37.606 75.211 0.396 3.61 4 14.7 1.6
119 4 4 2 37.612 75.224 0.396 3.61 4 38.1 10.6
120 5 5 -2 37.816 75.632 0.398 3.57 4 9.7 0.7
121 3 5 2 37.94 75.88 0.399 3.55 4 104.1 77.9
122 1 5 -3 37.96 75.919 0.399 3.55 4 2.3 0.0
123 1 7 -1 38.27 76.539 0.402 3.5 4 44.8 14.2
124 3 5 -3 38.704 77.409 0.406 3.43 4 18.6 2.4
125 7 3 -2 38.76 77.52 0.406 3.42 4 30.2 6.3
126 2 4 3 38.873 77.746 0.407 3.41 4 2.2 0.0
127 5 3 2 38.944 77.888 0.408 3.4 4 30.3 6.3
128 7 3 0 38.954 77.908 0.408 3.4 4 5.1 0.2
129 3 3 3 39.025 78.05 0.409 3.39 4 2.2 0.0
130 1 7 1 39.074 78.147 0.409 3.38 4 55.6 21.2
131 4 2 -4 39.083 78.167 0.409 3.38 4 31.1 6.6
132 0 2 4 39.206 78.412 0.41 3.36 4 13.2 1.2
133 7 1 -3 39.28 78.559 0.411 3.35 4 42.2 12.1
134 7 1 1 39.666 79.331 0.414 3.3 4 28.1 5.3
135 5 1 -4 39.724 79.449 0.415 3.29 4 16.1 1.7
136 5 5 1 39.769 79.539 0.415 3.28 4 19.4 2.5
137 4 6 -2 39.823 79.647 0.416 3.28 4 0.3 0.0
138 1 1 4 39.907 79.814 0.416 3.27 4 3.8 0.1
139 2 6 2 39.915 79.829 0.417 3.27 4 12.5 1.0
140 8 0 -2 39.975 79.95 0.417 3.26 2 32.7 3.5
141 3 3 -4 40.085 80.171 0.418 3.24 4 28.8 5.4
142 1 3 -4 40.146 80.293 0.419 3.24 4 16.3 1.7
143 6 0 2 40.188 80.376 0.419 3.23 2 11.9 0.5
144 1 5 3 40.363 80.727 0.42 3.21 4 26.2 4.5
145 3 7 0 40.457 80.914 0.421 3.2 4 13.9 1.3
146 4 6 1 40.564 81.128 0.422 3.19 4 26.7 4.6
147 3 7 -1 40.608 81.215 0.422 3.18 4 4.9 0.2
148 6 4 1 40.61 81.221 0.423 3.18 4 7.1 0.3
149 4 2 3 40.815 81.63 0.424 3.16 4 11.3 0.8
150 8 2 -1 40.834 81.669 0.424 3.16 4 33.6 7.2
151 8 0 0 40.961 81.923 0.426 3.14 2 74.2 17.5
152 8 2 -2 41.68 83.36 0.432 3.07 4 26.8 4.5
153 6 4 -3 41.811 83.622 0.433 3.06 4 39.1 9.4
154 6 2 2 41.891 83.782 0.433 3.05 4 42.0 10.9
155 1 7 -2 41.909 83.819 0.434 3.05 4 39.9 9.8
156 6 0 -4 41.99 83.98 0.434 3.04 2 104.1 33.3
157 2 0 4 42.231 84.462 0.436 3.02 2 15.7 0.8
158 5 5 -3 42.554 85.108 0.439 2.99 4 31.7 6.1
159 2 6 -3 42.644 85.287 0.44 2.98 4 17.3 1.8
160 8 2 0 42.659 85.318 0.44 2.98 4 20.1 2.4
161 7 3 -3 42.688 85.377 0.44 2.98 4 29.1 5.1
162 2 4 -4 42.704 85.408 0.44 2.98 4 0.4 0.0
163 3 7 1 42.976 85.953 0.443 2.96 4 5.5 0.2
164 7 3 1 43.068 86.136 0.443 2.95 4 22.2 2.9
165 5 3 -4 43.126 86.252 0.444 2.94 4 29.3 5.1
166 1 3 4 43.306 86.612 0.445 2.93 4 9.8 0.6
167 0 8 0 43.338 86.675 0.445 2.93 2 4.6 0.1
168 3 7 -2 43.424 86.847 0.446 2.92 4 12.0 0.9
169 0 6 3 43.46 86.92 0.446 2.92 4 33.5 6.6
170 1 7 2 43.484 86.967 0.447 2.92 4 6.9 0.3
171 6 2 -4 43.682 87.363 0.448 2.91 4 4.6 0.1
172 2 2 4 43.922 87.843 0.45 2.89 4 53.7 16.8
173 4 4 -4 44.185 88.37 0.452 2.87 4 23.7 3.3
174 5 1 3 44.204 88.408 0.453 2.87 4 15.5 1.4
175 0 4 4 44.305 88.61 0.453 2.87 4 10.9 0.7
176 7 5 -1 44.325 88.65 0.454 2.86 4 6.4 0.2
177 6 6 -1 44.354 88.708 0.454 2.86 4 24.1 3.4
178 0 8 1 44.664 89.328 0.456 2.85 4 26.4 4.0
179 2 8 0 44.877 89.755 0.458 2.83 4 28.6 4.7
180 4 6 -3 44.91 89.819 0.458 2.83 4 19.2 2.1
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 9.879 19.759 4.4895 37.8 3.1 3.1 5.6
2 1 1 1 12.116 24.231 3.66998 32.8 2.7 2.7 5.6
3 0 2 1 13.255 26.51 3.35953 131.9 10.9 10.9 5.6
4 2 2 0 13.725 27.451 3.24644 314.4 26.0 26.0 5.6
5 2 2 -1 14.856 29.712 3.00427 1210.5 100.0 100.0 5.6
6 3 1 0 15.092 30.184 2.95841 320.5 26.5 26.5 5.6
7 3 1 -1 15.385 30.771 2.90334 426.6 35.2 35.2 5.6
8 1 3 0 15.67 31.339 2.85193 14.9 1.2 1.2 5.6
9 1 3 -1 17.381 34.762 2.57856 284.9 23.5 23.4 5.7
10 2 0 -2 17.658 35.315 2.53943 23.6 2.0 1.9 5.7
11 0 0 2 17.709 35.419 2.53224 490.7 40.5 40.3 5.7
12 2 2 1 17.768 35.535 2.52421 487.7 40.3 40.1 5.7
13 3 1 1 19.503 39.006 2.3072 198.4 16.4 16.3 5.7
14 1 1 2 20.294 40.588 2.22087 107.6 8.9 8.8 5.7
15 2 2 -2 20.395 40.79 2.21034 17.3 1.4 1.4 5.7
16 0 2 2 20.441 40.882 2.20559 106.7 8.8 8.7 5.7
17 3 3 0 20.849 41.698 2.16429 108.1 8.9 8.8 5.7
18 3 3 -1 21.071 42.143 2.14245 204.2 16.9 16.7 5.7
19 4 2 -1 21.357 42.714 2.11513 96.3 8.0 7.9 5.7
20 4 2 0 21.713 43.427 2.08204 12.4 1.0 1.0 5.7
21 0 4 1 22.046 44.091 2.0522 222.8 18.4 18.2 5.7
22 4 0 -2 22.399 44.798 2.02144 134.4 11.1 10.9 5.7
23 2 0 2 22.526 45.053 2.0106 77.3 6.4 6.3 5.7
24 1 3 -2 22.93 45.859 1.9771 83.4 6.9 6.8 5.7
25 3 3 1 24.376 48.751 1.86636 24.6 2.0 2.0 5.7
26 5 1 0 24.746 49.493 1.84012 76.4 6.3 6.2 5.7
27 2 2 2 24.82 49.641 1.83499 34.8 2.9 2.8 5.7
28 1 3 2 25.042 50.084 1.81976 40.5 3.3 3.3 5.7
29 1 5 0 25.893 51.786 1.7639 155.3 12.8 12.5 5.8
30 5 1 -2 26.515 53.03 1.7254 21.2 1.7 1.7 5.8
31 1 5 -1 27.062 54.124 1.69308 13.7 1.1 1.1 5.8
32 0 4 2 27.294 54.589 1.67977 53.5 4.4 4.3 5.8
33 3 1 -3 27.581 55.163 1.66364 71.4 5.9 5.7 5.8
34 2 2 -3 28.208 56.416 1.62963 354.7 29.3 28.5 5.8
35 4 4 0 28.329 56.659 1.62322 56.1 4.6 4.5 5.8
36 5 3 0 28.937 57.873 1.59201 20.5 1.7 1.6 5.8
37 6 0 0 29.45 58.9 1.56669 40.1 3.3 3.2 5.8
38 3 5 0 29.629 59.259 1.55805 51.3 4.2 4.1 5.8
39 6 0 -2 30.14 60.28 1.53408 54.7 4.5 4.4 5.8
40 6 2 -1 30.213 60.426 1.53071 25.4 2.1 2.0 5.8
41 4 0 2 30.312 60.624 1.52618 70.8 5.9 5.7 5.8
42 5 3 -2 30.538 61.076 1.51596 15.0 1.2 1.2 5.8
43 1 3 -3 30.697 61.394 1.50888 144.6 11.9 11.5 5.8
44 0 6 0 30.979 61.958 1.4965 71.4 5.9 5.7 5.8
45 4 4 1 31.673 63.346 1.467 18.3 1.5 1.5 5.9
46 6 2 -2 32.047 64.094 1.45167 27.2 2.2 2.2 5.9
47 4 2 2 32.213 64.427 1.44497 14.8 1.2 1.2 5.9
48 0 6 1 32.461 64.922 1.43516 26.2 2.2 2.1 5.9
49 5 3 1 32.675 65.35 1.42678 206.1 17.0 16.3 5.9
50 3 5 -2 32.953 65.905 1.4161 102.4 8.5 8.1 5.9
51 1 5 2 33.018 66.036 1.4136 46.7 3.9 3.7 5.9
52 2 2 3 33.558 67.116 1.39347 49.0 4.0 3.9 5.9
53 7 1 -1 33.932 67.864 1.37991 26.1 2.2 2.1 5.9
54 0 4 3 34.814 69.628 1.3492 17.6 1.5 1.4 5.9
55 7 1 -2 35.249 70.498 1.33468 71.9 5.9 5.6 5.9
56 6 2 1 35.388 70.777 1.3301 43.7 3.6 3.4 5.9
57 7 1 0 35.45 70.899 1.3281 25.6 2.1 2.0 5.9
58 5 3 -3 35.645 71.291 1.32177 37.3 3.1 2.9 5.9
59 3 1 -4 36.617 73.234 1.29141 41.5 3.4 3.2 6.0
60 2 6 -2 36.687 73.375 1.28928 59.6 4.9 4.7 6.0
61 0 6 2 36.719 73.437 1.28834 67.6 5.6 5.3 6.0
62 4 0 -4 37.348 74.696 1.26971 28.5 2.4 2.2 6.0
63 0 0 4 37.472 74.945 1.26612 54.5 4.5 4.2 6.0
64 4 4 2 37.612 75.224 1.26211 12.2 1.0 0.9 6.0
65 3 5 2 37.94 75.88 1.25282 78.0 6.4 6.1 6.0
66 1 7 -1 38.27 76.539 1.24366 14.2 1.2 1.1 6.0
67 1 7 1 39.074 78.147 1.22205 27.8 2.3 2.1 6.0
68 8 0 0 40.961 81.923 1.17501 17.5 1.4 1.3 6.1
69 6 2 2 41.891 83.782 1.1536 20.7 1.7 1.6 6.1
70 6 0 -4 41.99 83.98 1.15139 33.3 2.8 2.5 6.1
71 2 2 4 43.922 87.843 1.11043 16.8 1.4 1.3 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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