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 ***
***********************
DIOPSIDE
42, td-diopside, Di(80)En(20), at 400'C, f-pyroxenes, s-diopside, DF
Ca(0.8)Mg(1.2)Si(2)O(6)
Monoclinic C 2/c Z = 4
R =0.047 NR =871
12 .1 .1993
Ref.Str.:
Benna P., Tribaudino M., Zanini G.,Bruno E. (1990)
* Z. Kristallogr., 192, 183-199
Reserv:
In original - clinopyroxene analogue.
Dokina T.N.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 9.765 alpha = 90.0
b = 8.963 beta = 106.58
c = 5.262 gamma = 90.0
Unit cell volume (cub. angs.) = 441.4
Molar volume ( cub.cm/mol.) = 66.47
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.9065 0.25 0.01 Mg = 1.00
2 0.0 0.2998 0.25 0.02 Ca = 0.8 , Ca = 0.0
3 0.0 0.2573 0.25 0.02 Mg = 0.2 , Mg = 0.0
4 0.2878 0.0926 0.2348 0.01 Si = 1.00
5 0.1166 0.0881 0.1433 0.01 O = 1.00
6 0.3635 0.2484 0.3249 0.02 O = 1.00
7 0.3503 0.0177 0.001 0.02 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.9065 0.25
2 2 0.0 0.2998 0.25
3 3 0.0 0.2573 0.25
4 4 0.2878 0.0926 0.2348
5 5 0.1166 0.0881 0.1433
6 6 0.3635 0.2484 0.3249
7 7 0.3503 0.0177 0.001
8 1 0.0 0.0935 0.75
9 2 0.0 0.7002 0.75
10 3 0.0 0.7427 0.75
11 4 0.7122 0.9074 0.7652
12 5 0.8834 0.9119 0.8567
13 6 0.6365 0.7516 0.6751
14 7 0.6497 0.9823 0.999
15 4 0.2878 0.9074 0.7348
16 5 0.1166 0.9119 0.6433
17 6 0.3635 0.7516 0.8249
18 7 0.3503 0.9823 0.501
19 4 0.7122 0.0926 0.2652
20 5 0.8834 0.0881 0.3567
21 6 0.6365 0.2484 0.1751
22 7 0.6497 0.0177 0.499
23 1 0.5 0.5935 0.75
24 2 0.5 0.2002 0.75
25 3 0.5 0.2427 0.75
26 4 0.7878 0.4074 0.7348
27 5 0.6166 0.4119 0.6433
28 6 0.8635 0.2516 0.8249
29 7 0.8503 0.4823 0.501
30 1 0.5 0.4065 0.25
31 2 0.5 0.7998 0.25
32 3 0.5 0.7573 0.25
33 4 0.2122 0.5926 0.2652
34 5 0.3834 0.5881 0.3567
35 6 0.1365 0.7484 0.1751
36 7 0.1497 0.5177 0.499
37 4 0.7878 0.5926 0.2348
38 5 0.6166 0.5881 0.1433
39 6 0.8635 0.7484 0.3249
40 7 0.8503 0.5177 0.001
41 4 0.2122 0.4074 0.7652
42 5 0.3834 0.4119 0.8567
43 6 0.1365 0.2516 0.6751
44 7 0.1497 0.4823 0.999
X-ray density (g/cm cub.) = 3.21
MU (1/cm) = 162.888 Mass attenuation coefficient (cm**2/g) = 50.742
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Mg 2.52 6
2.1508 5
2.0584 5
2.0584 5
2.1508 5
2.0591 6
2.0591 6
2 Ca ,Ca 2.88 8
2.3615 5
2.3615 5
2.2946 6
2.7675 7
2.5642 7
2.5642 7
2.2946 6
2.7675 7
3 Mg ,Mg 2.52 4
2.0679 5
2.0679 5
2.2542 6
2.2542 6
4 Si 2.1 4
1.6028 5
1.5878 6
1.6629 7
1.6805 7
5 O 3.264 11
2.7341 6
2.6724 7
2.8274 5
3.0686 5
3.0686 5
2.683 7
2.8117 5
2.9495 6
3.0525 6
3.1154 6
2.9203 6
6 O 3.264 10
2.7341 5
2.6593 7
2.5753 7
2.9879 6
2.9495 5
3.0525 5
3.1154 5
2.9203 5
3.2621 6
3.1067 7
7 O 3.264 8
2.6724 5
2.6593 6
2.9438 7
2.683 5
2.5753 6
2.6501 7
2.6501 7
3.1067 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 1 1 0 6.834 13.668 0.077 138.29 4 0.4 0.1
2 2 0 0 9.474 18.949 0.107 70.89 2 0.2 0.0
3 0 2 0 9.897 19.794 0.112 64.78 2 25.2 42.2
4 1 1 -1 10.027 20.054 0.113 63.06 4 6.8 6.0
5 1 1 1 12.201 24.401 0.137 41.91 4 12.3 13.0
6 0 2 1 13.293 26.587 0.149 34.98 4 51.8 192.3
7 2 2 0 13.768 27.536 0.154 32.47 4 70.5 331.4
8 2 2 -1 14.842 29.685 0.166 27.66 4 144.4 1184.3
9 3 1 0 15.156 30.311 0.17 26.45 4 84.0 383.0
10 3 1 -1 15.359 30.719 0.172 25.71 4 89.6 423.9
11 1 3 0 15.702 31.404 0.176 24.51 4 7.6 2.9
12 1 3 -1 17.397 34.795 0.194 19.63 4 89.8 325.1
13 2 0 -2 17.628 35.256 0.197 19.07 2 41.9 34.4
14 1 1 -2 17.768 35.536 0.198 18.74 4 5.1 1.0
15 0 0 2 17.787 35.573 0.198 18.7 2 159.9 490.6
16 2 2 1 17.885 35.77 0.199 18.48 4 109.7 456.7
17 1 3 1 18.79 37.58 0.209 16.58 4 16.7 9.5
18 4 0 0 19.221 38.442 0.214 15.77 2 13.0 2.8
19 3 1 1 19.661 39.322 0.218 14.99 4 79.5 194.8
20 0 4 0 20.106 40.212 0.223 14.27 2 0.6 0.0
21 3 1 -2 20.146 40.292 0.224 14.2 4 8.3 2.0
22 2 2 -2 20.378 40.756 0.226 13.85 4 21.2 12.7
23 1 1 2 20.428 40.856 0.227 13.77 4 65.2 120.0
24 0 2 2 20.518 41.037 0.228 13.64 4 61.3 105.1
25 3 3 0 20.915 41.83 0.232 13.06 4 59.6 95.3
26 3 3 -1 21.07 42.139 0.233 12.85 4 96.8 247.1
27 4 2 -1 21.351 42.702 0.236 12.47 4 61.4 96.6
28 4 2 0 21.801 43.602 0.241 11.9 4 22.8 12.7
29 0 4 1 22.096 44.192 0.244 11.55 4 95.3 215.2
30 4 0 -2 22.326 44.651 0.247 11.28 2 115.1 153.5
31 2 4 0 22.404 44.808 0.247 11.19 4 22.5 11.6
32 2 0 2 22.715 45.429 0.251 10.85 2 89.8 89.8
33 1 3 -2 22.963 45.926 0.253 10.59 4 56.5 69.4
34 2 4 -1 23.125 46.25 0.255 10.42 4 26.2 14.7
35 5 1 -1 23.904 47.808 0.263 9.67 4 14.4 4.1
36 3 3 1 24.524 49.048 0.269 9.12 4 34.8 22.7
37 4 2 -2 24.642 49.284 0.271 9.02 4 18.2 6.1
38 5 1 0 24.86 49.719 0.273 8.84 4 67.1 81.7
39 3 3 -2 24.932 49.865 0.274 8.78 4 12.4 2.8
40 2 2 2 25.003 50.006 0.274 8.73 4 53.2 50.7
41 1 3 2 25.172 50.343 0.276 8.6 4 46.8 38.6
42 2 4 1 25.323 50.646 0.278 8.48 4 25.4 11.2
43 4 2 1 25.838 51.677 0.283 8.1 4 27.2 12.3
44 1 5 0 25.945 51.89 0.284 8.02 4 98.8 160.7
45 5 1 -2 26.443 52.887 0.289 7.68 4 34.8 19.1
46 1 1 -3 26.75 53.5 0.292 7.48 4 16.0 3.9
47 3 1 2 26.901 53.802 0.294 7.39 4 29.0 12.7
48 1 5 -1 27.103 54.207 0.296 7.26 4 25.5 9.7
49 2 4 -2 27.266 54.533 0.297 7.16 4 32.4 15.5
50 0 4 2 27.379 54.758 0.299 7.1 4 64.1 59.9
51 3 1 -3 27.537 55.073 0.3 7.01 4 72.0 74.6
52 4 4 -1 28.054 56.108 0.305 6.72 4 9.9 1.4
53 1 5 1 28.105 56.209 0.306 6.69 4 6.6 0.6
54 5 3 -1 28.198 56.396 0.307 6.64 4 121.5 201.1
55 2 2 -3 28.217 56.433 0.307 6.63 4 130.2 230.5
56 4 4 0 28.423 56.846 0.309 6.52 4 65.6 57.6
57 5 3 0 29.053 58.105 0.315 6.21 4 38.5 18.9
58 5 1 1 29.06 58.12 0.315 6.2 4 2.6 0.1
59 0 2 3 29.3 58.6 0.318 6.09 4 3.3 0.1
60 6 0 0 29.592 59.184 0.321 5.95 2 91.1 50.7
61 3 5 0 29.709 59.417 0.322 5.9 4 66.1 52.9
62 1 1 3 29.71 59.421 0.322 5.9 4 2.3 0.1
63 3 5 -1 29.829 59.657 0.323 5.85 4 25.7 7.9
64 6 0 -2 30.072 60.143 0.325 5.74 2 106.1 66.4
65 6 2 -1 30.243 60.487 0.327 5.67 4 46.0 24.6
66 5 3 -2 30.487 60.973 0.329 5.57 4 35.6 14.5
67 4 0 2 30.598 61.196 0.33 5.53 2 118.7 79.9
68 1 3 -3 30.767 61.533 0.332 5.46 4 126.2 178.5
69 4 2 -3 30.774 61.548 0.332 5.46 4 18.7 3.9
70 4 4 -2 30.819 61.637 0.333 5.44 4 2.4 0.1
71 3 3 2 30.905 61.809 0.333 5.4 4 9.5 1.0
72 0 6 0 31.04 62.08 0.335 5.35 2 117.7 76.1
73 2 4 2 31.13 62.261 0.336 5.32 4 50.8 28.2
74 1 5 -2 31.331 62.662 0.338 5.24 4 11.1 1.3
75 3 3 -3 31.488 62.977 0.339 5.19 4 32.0 10.9
76 6 2 0 31.526 63.051 0.339 5.17 4 20.9 4.6
77 4 4 1 31.857 63.715 0.343 5.06 4 38.9 15.7
78 5 1 -3 31.889 63.778 0.343 5.04 4 26.2 7.1
79 6 2 -2 31.988 63.976 0.344 5.01 4 62.3 39.9
80 4 2 2 32.496 64.993 0.349 4.84 4 40.0 15.9
81 0 6 1 32.533 65.066 0.349 4.83 4 48.6 23.4
82 3 5 1 32.612 65.223 0.35 4.81 4 28.0 7.7
83 2 6 0 32.771 65.541 0.351 4.76 4 26.8 7.0
84 5 3 1 32.899 65.797 0.353 4.72 4 167.5 271.8
85 3 5 -2 32.953 65.905 0.353 4.7 4 109.1 114.8
86 1 5 2 33.153 66.306 0.355 4.64 4 68.8 45.1
87 2 6 -1 33.333 66.667 0.357 4.59 4 11.9 1.3
88 1 3 3 33.505 67.011 0.358 4.54 4 25.7 6.2
89 2 2 3 33.811 67.621 0.361 4.45 4 75.2 51.7
90 2 4 -3 33.968 67.936 0.363 4.41 4 49.4 22.1
91 7 1 -1 33.983 67.965 0.363 4.4 4 41.8 15.8
92 0 4 3 34.947 69.894 0.372 4.16 4 47.6 19.3
93 2 6 1 35.102 70.203 0.373 4.12 4 22.2 4.2
94 7 1 -2 35.194 70.389 0.374 4.1 4 107.8 97.8
95 5 3 -3 35.557 71.114 0.377 4.02 4 76.7 48.6
96 7 1 0 35.627 71.253 0.378 4.0 4 46.7 17.9
97 6 2 1 35.655 71.31 0.378 3.99 4 73.9 44.8
98 5 5 -1 35.756 71.512 0.379 3.97 4 4.6 0.2
99 5 1 2 35.777 71.553 0.379 3.97 4 46.8 17.8
100 6 4 -1 35.808 71.617 0.38 3.96 4 11.2 1.0
101 3 1 3 35.842 71.684 0.38 3.95 4 38.2 11.9
102 2 0 -4 35.847 71.694 0.38 3.95 2 20.7 1.7
103 4 4 -3 36.296 72.592 0.384 3.86 4 39.2 12.2
104 5 5 0 36.511 73.021 0.386 3.81 4 16.4 2.1
105 6 2 -3 36.524 73.049 0.386 3.81 4 9.7 0.7
106 3 1 -4 36.602 73.203 0.387 3.8 4 84.1 55.2
107 2 6 -2 36.726 73.453 0.388 3.77 4 77.5 46.5
108 1 1 -4 36.793 73.586 0.389 3.76 4 52.7 21.4
109 0 6 2 36.822 73.644 0.389 3.75 4 115.2 102.3
110 6 4 0 36.991 73.982 0.391 3.72 4 36.5 10.2
111 4 0 -4 37.278 74.555 0.393 3.67 2 91.3 31.4
112 1 7 0 37.386 74.772 0.394 3.65 4 1.1 0.0
113 4 6 -1 37.4 74.799 0.394 3.65 4 39.1 11.4
114 6 4 -2 37.421 74.841 0.394 3.64 4 11.3 1.0
115 7 3 -1 37.554 75.108 0.396 3.62 4 52.3 20.3
116 2 2 -4 37.613 75.226 0.396 3.61 4 28.6 6.1
117 0 0 4 37.658 75.315 0.397 3.6 2 113.5 47.6
118 4 6 0 37.718 75.436 0.397 3.59 4 20.1 3.0
119 5 5 -2 37.794 75.589 0.398 3.58 4 8.3 0.5
120 4 4 2 37.895 75.79 0.399 3.56 4 33.6 8.3
121 1 5 -3 38.048 76.095 0.4 3.54 4 11.1 0.9
122 3 5 2 38.173 76.345 0.401 3.52 4 121.2 105.9
123 1 7 -1 38.341 76.682 0.403 3.49 4 39.5 11.2
124 3 5 -3 38.704 77.408 0.406 3.43 4 26.9 5.1
125 7 3 -2 38.72 77.44 0.406 3.43 4 31.6 7.0
126 4 2 -4 39.02 78.04 0.409 3.39 4 39.1 10.6
127 2 4 3 39.13 78.26 0.41 3.37 4 3.8 0.1
128 7 3 0 39.137 78.275 0.41 3.37 4 10.4 0.8
129 7 1 -3 39.15 78.3 0.41 3.37 4 50.2 17.4
130 1 7 1 39.183 78.366 0.41 3.36 4 60.3 25.1
131 5 3 2 39.283 78.565 0.411 3.35 4 30.2 6.3
132 3 3 3 39.346 78.692 0.412 3.34 4 6.0 0.2
133 0 2 4 39.395 78.79 0.412 3.33 4 21.5 3.2
134 5 1 -4 39.611 79.222 0.414 3.3 4 18.8 2.4
135 4 6 -2 39.826 79.652 0.416 3.28 4 8.7 0.5
136 8 0 -2 39.935 79.87 0.417 3.26 2 39.8 5.3
137 7 1 1 39.981 79.963 0.417 3.26 4 33.6 7.6
138 5 5 1 40.001 80.001 0.417 3.25 4 14.5 1.4
139 3 3 -4 40.083 80.165 0.418 3.24 4 32.6 7.1
140 2 6 2 40.105 80.211 0.418 3.24 4 0.5 0.0
141 1 1 4 40.171 80.341 0.419 3.23 4 3.8 0.1
142 1 3 -4 40.269 80.538 0.42 3.22 4 15.8 1.7
143 3 7 0 40.563 81.125 0.422 3.19 4 14.5 1.4
144 1 5 3 40.564 81.129 0.422 3.19 4 26.1 4.5
145 6 0 2 40.586 81.172 0.422 3.18 2 11.3 0.4
146 3 7 -1 40.667 81.335 0.423 3.17 4 13.1 1.1
147 4 6 1 40.761 81.523 0.424 3.16 4 25.2 4.1
148 6 4 1 40.884 81.768 0.425 3.15 4 6.5 0.3
149 8 2 -1 40.919 81.837 0.425 3.15 4 37.9 9.3
150 8 0 0 41.18 82.36 0.427 3.12 2 87.9 24.8
151 4 2 3 41.206 82.411 0.428 3.12 4 10.3 0.7
152 8 2 -2 41.646 83.292 0.431 3.07 4 33.3 7.0
153 6 4 -3 41.718 83.437 0.432 3.06 4 41.1 10.6
154 6 0 -4 41.838 83.677 0.433 3.05 2 122.6 47.1
155 1 7 -2 41.994 83.989 0.434 3.04 4 43.7 11.9
156 6 2 2 42.292 84.584 0.437 3.01 4 43.7 11.8
157 5 5 -3 42.495 84.989 0.438 2.99 4 36.3 8.1
158 7 3 -3 42.573 85.146 0.439 2.99 4 32.2 6.4
159 2 0 4 42.576 85.152 0.439 2.99 2 25.1 1.9
160 2 6 -3 42.699 85.399 0.44 2.98 4 17.6 1.9
161 2 4 -4 42.77 85.541 0.441 2.97 4 3.9 0.1
162 8 2 0 42.882 85.765 0.442 2.96 4 29.6 5.3
163 5 3 -4 43.027 86.053 0.443 2.95 4 28.5 4.9
164 3 7 1 43.149 86.298 0.444 2.94 4 0.7 0.0
165 7 3 1 43.391 86.783 0.446 2.93 4 22.7 3.1
166 0 8 0 43.434 86.868 0.446 2.92 2 5.9 0.1
167 3 7 -2 43.46 86.92 0.446 2.92 4 14.9 1.3
168 6 2 -4 43.537 87.074 0.447 2.91 4 6.5 0.3
169 1 3 4 43.578 87.156 0.447 2.91 4 7.5 0.3
170 0 6 3 43.615 87.23 0.448 2.91 4 37.7 8.5
171 1 7 2 43.644 87.287 0.448 2.91 4 11.7 0.8
172 4 4 -4 44.141 88.283 0.452 2.88 4 24.7 3.6
173 2 2 4 44.271 88.543 0.453 2.87 4 64.9 24.8
174 7 5 -1 44.408 88.816 0.454 2.86 4 4.7 0.1
175 6 6 -1 44.429 88.857 0.454 2.86 4 27.8 4.6
176 0 4 4 44.509 89.017 0.455 2.85 4 13.7 1.1
177 5 1 3 44.673 89.347 0.456 2.85 4 17.8 1.8
178 0 8 1 44.771 89.543 0.457 2.84 4 30.3 5.4
179 4 6 -3 44.893 89.786 0.458 2.83 4 19.8 2.3
180 2 8 0 44.987 89.975 0.459 2.83 4 24.3 3.4
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 9.897 19.794 4.4815 42.2 3.6 3.6 5.6
2 1 1 1 12.201 24.401 3.64485 13.0 1.1 1.1 5.6
3 0 2 1 13.293 26.587 3.34996 192.3 16.2 16.3 5.6
4 2 2 0 13.768 27.536 3.23663 331.4 28.0 28.0 5.6
5 2 2 -1 14.842 29.685 3.00702 1184.3 100.0 100.0 5.6
6 3 1 0 15.156 30.311 2.9463 383.0 32.3 32.3 5.6
7 3 1 -1 15.359 30.719 2.90814 423.9 35.8 35.8 5.6
8 1 3 -1 17.397 34.795 2.57622 325.1 27.4 27.3 5.7
9 2 0 -2 17.628 35.256 2.54353 34.4 2.9 2.9 5.7
10 0 0 2 17.787 35.573 2.52161 491.6 41.5 41.3 5.7
11 2 2 1 17.885 35.77 2.50818 456.7 38.6 38.4 5.7
12 3 1 1 19.661 39.322 2.2894 194.8 16.4 16.3 5.7
13 2 2 -2 20.378 40.756 2.21207 12.7 1.1 1.1 5.7
14 1 1 2 20.428 40.856 2.20693 120.0 10.1 10.0 5.7
15 0 2 2 20.518 41.037 2.19761 105.1 8.9 8.8 5.7
16 3 3 0 20.915 41.83 2.15776 95.3 8.1 8.0 5.7
17 3 3 -1 21.07 42.139 2.14263 247.1 20.9 20.6 5.7
18 4 2 -1 21.351 42.702 2.11567 96.6 8.2 8.1 5.7
19 4 2 0 21.801 43.602 2.07409 12.7 1.1 1.1 5.7
20 0 4 1 22.096 44.192 2.04773 215.2 18.2 17.9 5.7
21 4 0 -2 22.326 44.651 2.02774 153.5 13.0 12.8 5.7
22 2 0 2 22.715 45.429 1.99481 89.8 7.6 7.5 5.7
23 1 3 -2 22.963 45.926 1.97437 69.4 5.9 5.8 5.7
24 2 4 -1 23.125 46.25 1.96129 14.7 1.2 1.2 5.7
25 3 3 1 24.524 49.048 1.85576 22.7 1.9 1.9 5.7
26 5 1 0 24.86 49.719 1.83227 81.7 6.9 6.8 5.7
27 2 2 2 25.003 50.006 1.82242 50.7 4.3 4.2 5.7
28 1 3 2 25.172 50.343 1.81101 38.6 3.3 3.2 5.8
29 4 2 1 25.838 51.677 1.76738 12.3 1.0 1.0 5.8
30 1 5 0 25.945 51.89 1.7606 160.7 13.6 13.3 5.8
31 5 1 -2 26.443 52.887 1.72975 19.1 1.6 1.6 5.8
32 3 1 2 26.901 53.802 1.70247 12.7 1.1 1.0 5.8
33 2 4 -2 27.266 54.533 1.68136 15.5 1.3 1.3 5.8
34 0 4 2 27.379 54.758 1.67498 59.9 5.1 4.9 5.8
35 3 1 -3 27.537 55.073 1.66613 74.6 6.3 6.1 5.8
36 2 2 -3 28.217 56.433 1.62916 431.7 36.4 35.4 5.8
37 4 4 0 28.423 56.846 1.61832 57.6 4.9 4.7 5.8
38 5 3 0 29.053 58.105 1.58621 19.0 1.6 1.6 5.8
39 6 0 0 29.592 59.184 1.55983 50.7 4.3 4.1 5.8
40 3 5 0 29.709 59.417 1.55428 52.9 4.5 4.3 5.8
41 6 0 -2 30.072 60.143 1.53723 66.4 5.6 5.4 5.8
42 6 2 -1 30.243 60.487 1.52933 24.6 2.1 2.0 5.8
43 5 3 -2 30.487 60.973 1.51828 14.5 1.2 1.2 5.8
44 4 0 2 30.598 61.196 1.5133 79.9 6.7 6.5 5.8
45 1 3 -3 30.767 61.533 1.5058 182.5 15.4 14.9 5.8
46 0 6 0 31.04 62.08 1.49383 76.1 6.4 6.2 5.8
47 2 4 2 31.13 62.261 1.48994 28.2 2.4 2.3 5.8
48 4 4 1 31.857 63.715 1.4594 15.7 1.3 1.3 5.9
49 6 2 -2 31.988 63.976 1.45407 39.9 3.4 3.2 5.9
50 4 2 2 32.496 64.993 1.43376 15.9 1.3 1.3 5.9
51 0 6 1 32.533 65.066 1.43232 23.4 2.0 1.9 5.9
52 5 3 1 32.899 65.797 1.41816 271.8 22.9 22.0 5.9
53 3 5 -2 32.953 65.905 1.4161 114.8 9.7 9.3 5.9
54 1 5 2 33.153 66.306 1.4085 45.1 3.8 3.6 5.9
55 2 2 3 33.811 67.621 1.38427 51.7 4.4 4.2 5.9
56 2 4 -3 33.968 67.936 1.37864 37.8 3.2 3.1 5.9
57 0 4 3 34.947 69.894 1.34471 19.3 1.6 1.6 5.9
58 7 1 -2 35.194 70.389 1.33648 97.8 8.3 7.8 5.9
59 5 3 -3 35.557 71.114 1.32461 48.6 4.1 3.9 5.9
60 6 2 1 35.655 71.31 1.32145 62.6 5.3 5.0 5.9
61 5 1 2 35.777 71.553 1.31756 17.8 1.5 1.4 5.9
62 3 1 3 35.842 71.684 1.31547 13.6 1.1 1.1 5.9
63 4 4 -3 36.296 72.592 1.30124 12.2 1.0 1.0 6.0
64 3 1 -4 36.602 73.203 1.29188 55.2 4.7 4.4 6.0
65 2 6 -2 36.726 73.453 1.28811 46.5 3.9 3.7 6.0
66 0 6 2 36.822 73.644 1.28523 123.8 10.5 9.9 6.0
67 4 0 -4 37.278 74.555 1.27176 31.4 2.7 2.5 6.0
68 4 6 -1 37.4 74.799 1.26822 12.4 1.0 1.0 6.0
69 7 3 -1 37.554 75.108 1.26377 20.3 1.7 1.6 6.0
70 0 0 4 37.658 75.315 1.2608 47.6 4.0 3.8 6.0
71 3 5 2 38.173 76.345 1.24634 105.9 8.9 8.4 6.0
72 7 3 -2 38.72 77.44 1.23144 12.2 1.0 1.0 6.0
73 7 1 -3 39.15 78.3 1.22005 17.4 1.5 1.4 6.0
74 1 7 1 39.183 78.366 1.21918 25.1 2.1 2.0 6.0
75 8 0 0 41.18 82.36 1.16987 25.4 2.1 2.0 6.1
76 6 0 -4 41.838 83.677 1.15479 47.1 4.0 3.7 6.1
77 1 7 -2 41.994 83.989 1.15129 11.9 1.0 0.9 6.1
78 2 2 4 44.271 88.543 1.10346 24.8 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)
|