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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CECHITE
1, f-descloizite, g-descloizite
Pb(Fe'',Mn'')[VO(4)](OH)
Orthorhombic P nam Z = 4
R =0.043 NR =931
9 .3 .1995
Ref.Str.:
Petlik F. (1989)
* Neues Jb. Miner., Mh., H.1, 34-40
Reserv:
See U(ij) in the article. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 7.605 alpha = 90.0
b = 9.435 beta = 90.0
c = 6.099 gamma = 90.0
Unit cell volume (cub. angs.) = 437.62
Molar volume ( cub.cm/mol.) = 65.9
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.1306 0.1743 0.25 0.0 Pb = 1.00
2 0.5 0.0 0.0 0.0 Fe = 0.8 , Mn = 0.2
3 0.8747 0.1907 0.75 0.0 V = 1.00
4 0.8751 0.2938 0.5113 0.0 O = 1.00
5 0.0399 0.0851 0.75 0.0 O = 1.00
6 0.6865 0.0758 0.75 0.0 O = 1.00
7 0.6507 0.0693 0.25 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.1306 0.1743 0.25
2 2 0.5 0.0 0.0
3 3 0.8747 0.1907 0.75
4 4 0.8751 0.2938 0.5113
5 5 0.0399 0.0851 0.75
6 6 0.6865 0.0758 0.75
7 7 0.6507 0.0693 0.25
8 1 0.8694 0.8257 0.75
9 3 0.1253 0.8093 0.25
10 4 0.1249 0.7062 0.4887
11 5 0.9601 0.9149 0.25
12 6 0.3135 0.9242 0.25
13 7 0.3493 0.9307 0.75
14 1 0.6306 0.3257 0.25
15 2 0.0 0.5 0.0
16 3 0.3747 0.3093 0.75
17 4 0.3751 0.2062 0.5113
18 5 0.5399 0.4149 0.75
19 6 0.1865 0.4242 0.75
20 7 0.1507 0.4307 0.25
21 1 0.3694 0.6743 0.75
22 3 0.6253 0.6907 0.25
23 4 0.6249 0.7938 0.4887
24 5 0.4601 0.5851 0.25
25 6 0.8135 0.5758 0.25
26 7 0.8493 0.5693 0.75
27 2 0.5 0.0 0.5
28 4 0.1249 0.7062 0.0113
29 4 0.8751 0.2938 0.9887
30 2 0.0 0.5 0.5
31 4 0.6249 0.7938 0.0113
32 4 0.3751 0.2062 0.9887
X-ray density (g/cm cub.) = 5.98
MU (1/cm) = 1179.719 Mass attenuation coefficient (cm**2/g) = 197.439
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Pb 3.144 7
2.7544 4
2.7697 5
2.7391 6
2.4674 4
2.424 7
2.7544 4
2.4674 4
2 Fe ,Mn 2.724 6
2.2018 6
2.0164 7
2.2018 6
2.0164 7
2.1661 4
2.1661 4
3 V 2.496 4
1.7509 4
1.6035 5
1.7955 6
1.7509 4
4 O 3.264 10
2.7509 5
2.8995 6
3.1526 7
3.1501 5
3.04 6
2.9328 7
3.1366 6
2.9857 7
2.9117 4
3.1873 4
5 O 3.264 6
2.7509 4
2.689 6
2.7674 7
3.1501 4
2.7509 4
3.1501 4
6 O 3.264 10
2.8995 4
2.689 5
3.0622 7
3.0622 7
2.907 7
3.04 4
3.1366 4
2.8995 4
3.1366 4
3.04 4
7 O 3.264 10
3.1526 4
3.0622 6
3.0622 6
2.7674 5
2.907 6
2.9328 4
2.9857 4
3.1526 4
2.9857 4
2.9328 4
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 7.475 14.95 0.084 115.22 4 5.7 7.8
2 0 1 1 8.649 17.299 0.098 85.5 4 174.8 5457.8
3 0 2 0 9.397 18.795 0.106 72.09 2 130.0 1273.1
4 1 1 1 10.446 20.893 0.118 57.93 8 109.0 2875.2
5 1 2 0 11.078 22.156 0.125 51.27 4 125.0 1674.4
6 2 0 0 11.687 23.375 0.131 45.85 2 61.5 180.9
7 2 1 0 12.615 25.231 0.142 39.06 4 159.5 2074.6
8 1 2 1 13.293 26.587 0.149 34.98 8 97.2 1381.5
9 2 0 1 13.811 27.622 0.155 32.26 4 336.1 7611.0
10 2 1 1 14.613 29.226 0.164 28.6 8 23.3 64.7
11 0 0 2 14.631 29.262 0.164 28.53 2 281.1 2354.1
12 2 2 0 15.081 30.162 0.169 26.74 4 86.2 415.4
13 1 3 0 15.369 30.739 0.172 25.67 4 281.6 4251.0
14 0 3 1 15.996 31.992 0.179 23.55 4 32.4 51.8
15 1 1 2 16.507 33.013 0.184 22.0 8 184.5 3128.4
16 2 2 1 16.811 33.622 0.188 21.15 8 202.7 3629.9
17 1 3 1 17.073 34.146 0.191 20.45 8 230.1 4521.6
18 0 2 2 17.504 35.008 0.195 19.37 4 195.7 1548.9
19 3 1 0 18.339 36.678 0.204 17.49 4 122.2 545.1
20 1 2 2 18.504 37.008 0.206 17.15 8 81.0 470.5
21 2 3 0 18.532 37.065 0.206 17.09 4 67.6 163.1
22 2 0 2 18.892 37.784 0.21 16.38 4 95.4 311.3
23 0 4 0 19.06 38.121 0.212 16.06 2 7.1 0.8
24 2 1 2 19.507 39.014 0.217 15.26 8 229.5 3355.9
25 3 1 1 19.818 39.636 0.22 14.73 8 62.6 241.1
26 1 4 0 19.993 39.987 0.222 14.45 4 188.7 1074.0
27 2 3 1 20.0 39.999 0.222 14.44 8 8.0 3.9
28 3 2 0 20.179 40.357 0.224 14.15 4 129.2 493.4
29 2 2 2 21.262 42.523 0.235 12.59 8 64.2 216.9
30 1 4 1 21.376 42.752 0.237 12.44 8 139.6 1012.7
31 1 3 2 21.477 42.954 0.238 12.31 8 160.0 1316.4
32 3 2 1 21.552 43.104 0.238 12.22 8 141.7 1024.7
33 2 4 0 22.6 45.199 0.249 10.98 4 70.8 114.8
34 0 1 3 22.804 45.609 0.252 10.76 4 157.9 560.1
35 3 3 0 22.972 45.944 0.253 10.58 4 142.5 448.7
36 1 1 3 23.616 47.231 0.26 9.94 8 94.5 370.8
37 3 1 2 23.796 47.592 0.262 9.77 8 3.2 0.4
38 2 4 1 23.861 47.721 0.263 9.71 8 65.6 174.7
39 4 0 0 23.9 47.8 0.263 9.67 2 270.4 738.3
40 2 3 2 23.953 47.906 0.264 9.62 8 5.5 1.2
41 3 3 1 24.218 48.435 0.266 9.38 8 185.3 1346.4
42 0 4 2 24.384 48.768 0.268 9.24 4 174.7 588.7
43 4 1 0 24.412 48.823 0.268 9.22 4 34.5 22.9
44 1 5 0 24.871 49.743 0.273 8.83 4 54.6 55.0
45 4 0 1 25.111 50.222 0.275 8.64 4 41.4 30.9
46 1 2 3 25.14 50.279 0.276 8.62 8 82.9 247.4
47 1 4 2 25.157 50.313 0.276 8.61 8 126.1 572.0
48 0 5 1 25.296 50.592 0.277 8.5 4 159.3 450.6
49 3 2 2 25.312 50.624 0.278 8.49 8 91.8 298.9
50 2 0 3 25.445 50.89 0.279 8.39 4 278.7 1360.1
51 4 1 1 25.604 51.209 0.281 8.27 8 161.1 896.3
52 4 2 0 25.9 51.801 0.284 8.05 4 264.9 1180.4
53 2 1 3 25.934 51.867 0.284 8.03 8 18.9 12.0
54 1 5 1 26.049 52.097 0.285 7.95 8 154.3 791.2
55 3 4 0 26.491 52.983 0.29 7.65 4 109.0 189.9
56 0 3 3 26.818 53.636 0.293 7.44 4 30.8 14.8
57 4 2 1 27.046 54.091 0.295 7.3 8 15.4 7.2
58 2 5 0 27.11 54.22 0.296 7.26 4 130.7 259.2
59 2 2 3 27.363 54.725 0.298 7.11 8 167.5 833.0
60 2 4 2 27.379 54.758 0.299 7.1 8 60.5 108.7
61 1 3 3 27.541 55.083 0.3 7.0 8 205.0 1228.9
62 3 4 1 27.62 55.239 0.301 6.96 8 120.8 424.2
63 3 3 2 27.703 55.406 0.302 6.91 8 295.2 2515.3
64 2 5 1 28.221 56.443 0.307 6.63 8 8.6 2.0
65 4 3 0 28.257 56.513 0.307 6.61 4 7.4 0.7
66 4 0 2 28.518 57.036 0.31 6.47 4 311.1 1308.0
67 4 1 2 28.971 57.942 0.314 6.24 8 31.9 26.6
68 0 6 0 29.33 58.661 0.318 6.07 2 265.2 446.2
69 4 3 1 29.339 58.678 0.318 6.07 8 13.4 4.5
70 1 5 2 29.38 58.761 0.318 6.05 8 218.8 1209.8
71 3 1 3 29.505 59.009 0.32 5.99 8 60.5 91.7
72 2 3 3 29.64 59.28 0.321 5.93 8 5.5 0.7
73 1 6 0 30.014 60.027 0.325 5.77 4 27.5 9.1
74 4 2 2 30.304 60.608 0.328 5.65 8 76.4 137.7
75 0 0 4 30.344 60.687 0.328 5.63 2 406.2 969.7
76 3 5 0 30.589 61.179 0.33 5.53 4 219.6 556.9
77 1 4 3 30.687 61.374 0.331 5.49 8 115.7 307.2
78 3 2 3 30.823 61.647 0.333 5.44 8 120.9 331.9
79 3 4 2 30.838 61.677 0.333 5.43 8 65.3 96.6
80 5 1 0 30.862 61.724 0.333 5.42 4 131.6 196.1
81 1 6 1 31.058 62.116 0.335 5.35 8 13.0 3.8
82 4 4 0 31.357 62.714 0.338 5.23 4 108.3 128.1
83 2 5 2 31.401 62.802 0.338 5.22 8 114.0 283.4
84 1 1 4 31.444 62.888 0.339 5.2 8 17.2 6.5
85 3 5 1 31.622 63.245 0.34 5.14 8 142.5 436.1
86 5 1 1 31.89 63.78 0.343 5.04 8 97.9 202.1
87 2 6 0 32.011 64.021 0.344 5.0 4 43.5 19.7
88 0 2 4 32.067 64.135 0.345 4.98 4 104.5 113.8
89 5 2 0 32.148 64.295 0.345 4.96 4 101.7 107.0
90 4 4 1 32.376 64.753 0.348 4.88 8 13.0 3.5
91 4 3 2 32.452 64.904 0.348 4.86 8 6.3 0.8
92 2 4 3 32.661 65.321 0.35 4.79 8 63.4 80.3
93 1 2 4 32.717 65.434 0.351 4.77 8 96.6 185.9
94 3 3 3 32.952 65.905 0.353 4.7 8 168.9 560.0
95 2 0 4 32.976 65.952 0.353 4.69 4 39.0 14.9
96 2 6 1 33.019 66.038 0.354 4.68 8 239.6 1121.8
97 5 2 1 33.154 66.307 0.355 4.64 8 69.5 93.7
98 2 1 4 33.393 66.785 0.357 4.57 8 129.1 317.9
99 0 6 2 33.445 66.89 0.358 4.55 4 137.0 178.5
100 4 0 3 33.69 67.381 0.36 4.48 4 36.1 12.2
101 0 5 3 33.845 67.689 0.362 4.44 4 141.1 184.6
102 1 6 2 34.081 68.162 0.364 4.38 8 12.2 2.7
103 4 1 3 34.103 68.206 0.364 4.37 8 152.4 424.0
104 5 3 0 34.232 68.464 0.365 4.34 4 79.0 56.6
105 1 5 3 34.477 68.954 0.367 4.27 8 143.2 366.1
106 3 5 2 34.619 69.239 0.369 4.24 8 134.7 321.0
107 2 2 4 34.628 69.257 0.369 4.24 8 60.4 64.6
108 1 3 4 34.784 69.569 0.37 4.2 8 215.6 814.7
109 5 1 2 34.875 69.75 0.371 4.17 8 25.5 11.3
110 4 5 0 35.109 70.217 0.373 4.12 4 10.3 0.9
111 3 6 0 35.2 70.4 0.374 4.1 4 27.5 6.5
112 5 3 1 35.208 70.416 0.374 4.1 8 201.4 693.9
113 4 2 3 35.327 70.653 0.375 4.07 8 14.3 3.5
114 4 4 2 35.341 70.681 0.375 4.06 8 19.1 6.2
115 1 7 0 35.478 70.956 0.377 4.03 4 25.0 5.3
116 3 4 3 35.821 71.643 0.38 3.96 8 106.5 187.5
117 0 7 1 35.822 71.645 0.38 3.96 4 171.0 241.7
118 2 6 2 35.957 71.915 0.381 3.93 8 66.0 71.5
119 4 5 1 36.074 72.148 0.382 3.9 8 121.9 242.2
120 5 2 2 36.087 72.174 0.382 3.9 8 79.4 102.8
121 3 6 1 36.165 72.329 0.383 3.88 8 16.3 4.3
122 2 5 3 36.345 72.689 0.385 3.85 8 8.1 1.1
123 1 7 1 36.439 72.879 0.386 3.83 8 13.3 2.8
124 3 1 4 36.523 73.047 0.386 3.81 8 103.1 169.4
125 2 3 4 36.645 73.29 0.387 3.79 8 34.8 19.2
126 0 4 4 36.981 73.961 0.39 3.72 4 12.4 1.2
127 5 4 0 37.056 74.111 0.391 3.71 4 166.6 215.1
128 2 7 0 37.324 74.649 0.394 3.66 4 144.9 160.6
129 4 3 3 37.328 74.655 0.394 3.66 8 4.3 0.3
130 6 0 0 37.425 74.849 0.394 3.64 2 114.5 49.8
131 1 4 4 37.59 75.181 0.396 3.61 8 139.4 293.1
132 3 2 4 37.714 75.428 0.397 3.59 8 97.8 143.4
133 6 1 0 37.819 75.639 0.398 3.57 4 100.4 75.3
134 5 4 1 38.002 76.003 0.4 3.54 8 84.2 105.0
135 5 3 2 38.072 76.144 0.4 3.53 8 204.5 617.0
136 2 7 1 38.268 76.536 0.402 3.5 8 9.6 1.3
137 6 0 1 38.367 76.735 0.403 3.48 4 270.3 532.0
138 6 1 1 38.759 77.518 0.406 3.42 8 36.3 18.8
139 1 6 3 38.866 77.733 0.407 3.41 8 7.9 0.9
140 4 5 2 38.914 77.828 0.408 3.4 8 10.4 1.5
141 6 2 0 38.996 77.992 0.408 3.39 4 37.5 9.9
142 3 6 2 39.002 78.004 0.409 3.39 8 7.7 0.9
143 1 7 2 39.27 78.54 0.411 3.35 8 45.0 28.4
144 3 5 3 39.379 78.757 0.412 3.34 8 132.2 243.7
145 2 4 4 39.4 78.801 0.412 3.33 8 52.0 37.7
146 4 6 0 39.47 78.941 0.413 3.32 4 165.3 189.8
147 0 1 5 39.549 79.098 0.413 3.31 4 118.6 97.3
148 5 1 3 39.622 79.245 0.414 3.3 8 89.9 111.5
149 3 3 4 39.671 79.342 0.414 3.3 8 123.3 209.5
150 6 2 1 39.928 79.855 0.417 3.26 8 131.4 235.6
151 4 4 3 40.068 80.136 0.418 3.25 8 11.6 1.8
152 1 1 5 40.146 80.293 0.419 3.24 8 74.1 74.2
153 3 7 0 40.334 80.668 0.42 3.21 4 105.0 74.0
154 4 0 4 40.359 80.718 0.42 3.21 4 214.7 309.2
155 4 6 1 40.399 80.798 0.421 3.21 8 21.8 6.4
156 5 5 0 40.576 81.153 0.422 3.19 4 135.2 121.6
157 2 6 3 40.66 81.32 0.423 3.18 8 217.3 626.2
158 4 1 4 40.746 81.491 0.424 3.17 8 27.2 9.8
159 0 8 0 40.778 81.555 0.424 3.16 2 186.6 115.0
160 5 2 3 40.784 81.569 0.424 3.16 8 62.5 51.5
161 5 4 2 40.798 81.595 0.424 3.16 8 129.7 221.9
162 6 3 0 40.936 81.872 0.425 3.15 4 5.1 0.2
163 2 7 2 41.059 82.118 0.426 3.13 8 155.9 318.1
164 1 5 4 41.098 82.195 0.427 3.13 8 54.9 39.4
165 6 0 2 41.157 82.313 0.427 3.12 4 11.4 0.8
166 3 7 1 41.258 82.516 0.428 3.11 8 21.8 6.2
167 1 2 5 41.305 82.61 0.428 3.11 8 78.0 78.8
168 1 8 0 41.371 82.742 0.429 3.1 4 86.1 48.0
169 5 5 1 41.499 82.998 0.43 3.09 8 131.8 224.0
170 6 1 2 41.542 83.083 0.43 3.08 8 141.5 257.8
171 2 0 5 41.543 83.085 0.43 3.08 4 241.3 374.8
172 6 3 1 41.857 83.714 0.433 3.05 8 5.5 0.4
173 4 2 4 41.901 83.802 0.434 3.05 8 205.5 537.5
174 2 1 5 41.927 83.854 0.434 3.05 8 14.8 2.8
175 1 8 1 42.291 84.581 0.437 3.01 8 93.6 110.1
176 3 4 4 42.371 84.743 0.437 3.01 8 89.6 100.7
177 0 3 5 42.634 85.268 0.44 2.98 4 14.5 1.3
178 6 2 2 42.693 85.386 0.44 2.98 8 59.8 44.4
179 5 3 3 42.707 85.413 0.44 2.98 8 187.2 436.0
180 2 5 4 42.871 85.742 0.442 2.96 8 112.3 156.2
181 2 2 5 43.077 86.154 0.443 2.95 8 148.3 270.9
182 2 8 0 43.143 86.286 0.444 2.94 4 62.5 24.0
183 4 6 2 43.159 86.318 0.444 2.94 8 249.4 764.6
184 1 3 5 43.223 86.447 0.445 2.94 8 161.3 319.3
185 0 7 3 43.289 86.578 0.445 2.93 4 159.8 156.4
186 4 5 3 43.528 87.057 0.447 2.92 8 112.3 153.6
187 3 6 3 43.615 87.23 0.448 2.91 8 11.6 1.6
188 6 4 0 43.622 87.244 0.448 2.91 4 28.9 5.1
189 4 3 4 43.816 87.632 0.449 2.9 8 4.1 0.2
190 1 7 3 43.877 87.755 0.45 2.89 8 8.5 0.9
191 3 7 2 44.01 88.02 0.451 2.88 8 21.7 5.7
192 2 8 1 44.058 88.116 0.451 2.88 8 191.7 442.3
193 5 5 2 44.25 88.499 0.453 2.87 8 67.2 54.1
194 0 8 2 44.449 88.897 0.455 2.86 4 245.1 358.6
195 4 7 0 44.469 88.938 0.455 2.86 4 29.1 5.1
196 6 4 1 44.537 89.073 0.455 2.85 8 64.5 49.6
197 6 3 2 44.605 89.21 0.456 2.85 8 33.8 13.6
198 0 6 4 44.723 89.445 0.457 2.84 4 222.1 293.0
199 5 6 0 44.795 89.59 0.457 2.84 4 28.7 4.9
200 3 1 5 44.872 89.744 0.458 2.83 8 50.5 30.2
201 2 3 5 44.988 89.976 0.459 2.83 8 3.3 0.1
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 1 1 8.649 17.299 5.12202 5457.8 71.7 72.2 5.6
2 0 2 0 9.397 18.795 4.7175 1273.1 16.7 16.8 5.6
3 1 1 1 10.446 20.893 4.24832 2875.2 37.8 38.0 5.6
4 1 2 0 11.078 22.156 4.00885 1674.4 22.0 22.1 5.6
5 2 0 0 11.687 23.375 3.8025 180.9 2.4 2.4 5.6
6 2 1 0 12.615 25.231 3.52685 2074.6 27.3 27.3 5.6
7 1 2 1 13.293 26.587 3.34998 1381.5 18.2 18.2 5.6
8 2 0 1 13.811 27.622 3.22674 7611.0 100.0 100.0 5.6
9 0 0 2 14.631 29.262 3.0495 2418.8 31.8 31.7 5.6
10 2 2 0 15.081 30.162 2.96051 415.4 5.5 5.4 5.6
11 1 3 0 15.369 30.739 2.90629 4251.0 55.9 55.7 5.6
12 1 1 2 16.507 33.013 2.71106 3128.4 41.1 40.9 5.6
13 2 2 1 16.811 33.622 2.66332 3629.9 47.7 47.5 5.7
14 1 3 1 17.073 34.146 2.62364 4521.6 59.4 59.1 5.7
15 0 2 2 17.504 35.008 2.56101 1548.9 20.4 20.2 5.7
16 3 1 0 18.339 36.678 2.44817 545.1 7.2 7.1 5.7
17 1 2 2 18.504 37.008 2.42709 470.5 6.2 6.1 5.7
18 2 3 0 18.532 37.065 2.42348 163.1 2.1 2.1 5.7
19 2 0 2 18.892 37.784 2.37897 311.3 4.1 4.1 5.7
20 2 1 2 19.507 39.014 2.30677 3355.9 44.1 43.7 5.7
21 3 1 1 19.818 39.636 2.27197 241.1 3.2 3.1 5.7
22 1 4 0 19.993 39.987 2.25288 1077.8 14.2 14.0 5.7
23 3 2 0 20.179 40.357 2.23302 493.4 6.5 6.4 5.7
24 2 2 2 21.262 42.523 2.12416 216.9 2.8 2.8 5.7
25 1 4 1 21.376 42.752 2.11331 1012.7 13.3 13.1 5.7
26 1 3 2 21.477 42.954 2.10386 1316.4 17.3 17.1 5.7
27 3 2 1 21.552 43.104 2.09689 1024.7 13.5 13.3 5.7
28 2 4 0 22.6 45.199 2.00442 114.8 1.5 1.5 5.7
29 0 1 3 22.804 45.609 1.98739 560.1 7.4 7.2 5.7
30 3 3 0 22.972 45.944 1.97367 448.7 5.9 5.8 5.7
31 1 1 3 23.616 47.231 1.92282 370.8 4.9 4.8 5.7
32 2 4 1 23.861 47.721 1.90422 174.7 2.3 2.3 5.7
33 4 0 0 23.9 47.8 1.90125 738.3 9.7 9.5 5.7
34 3 3 1 24.218 48.435 1.8778 1346.4 17.7 17.3 5.7
35 0 4 2 24.384 48.768 1.86576 611.5 8.0 7.9 5.7
36 1 4 2 25.157 50.313 1.81202 850.3 11.2 10.9 5.8
37 0 5 1 25.296 50.592 1.80269 749.5 9.8 9.6 5.8
38 2 0 3 25.445 50.89 1.79284 1360.1 17.9 17.5 5.8
39 4 1 1 25.604 51.209 1.78242 896.3 11.8 11.5 5.8
40 4 2 0 25.9 51.801 1.76342 1180.4 15.5 15.1 5.8
41 1 5 1 26.049 52.097 1.75408 791.2 10.4 10.1 5.8
42 3 4 0 26.491 52.983 1.72684 189.9 2.5 2.4 5.8
43 2 5 0 27.11 54.22 1.69031 259.2 3.4 3.3 5.8
44 2 2 3 27.363 54.725 1.6759 941.7 12.4 12.0 5.8
45 1 3 3 27.541 55.083 1.66588 1228.9 16.1 15.7 5.8
46 3 4 1 27.62 55.239 1.66152 424.2 5.6 5.4 5.8
47 3 3 2 27.703 55.406 1.65692 2515.3 33.0 32.1 5.8
48 4 0 2 28.518 57.036 1.61337 1308.0 17.2 16.7 5.8
49 0 6 0 29.33 58.661 1.5725 450.7 5.9 5.7 5.8
50 1 5 2 29.38 58.761 1.57007 1209.8 15.9 15.4 5.8
51 3 1 3 29.505 59.009 1.56404 91.7 1.2 1.2 5.8
52 4 2 2 30.304 60.608 1.52656 137.7 1.8 1.7 5.8
53 0 0 4 30.344 60.687 1.52475 969.7 12.7 12.3 5.8
54 3 5 0 30.589 61.179 1.51367 556.9 7.3 7.1 5.8
55 1 4 3 30.687 61.374 1.50931 307.2 4.0 3.9 5.8
56 3 2 3 30.823 61.647 1.5033 428.5 5.6 5.4 5.8
57 5 1 0 30.862 61.724 1.50161 196.1 2.6 2.5 5.8
58 4 4 0 31.357 62.714 1.48025 128.1 1.7 1.6 5.8
59 2 5 2 31.401 62.802 1.47839 283.4 3.7 3.6 5.9
60 3 5 1 31.622 63.245 1.46911 436.1 5.7 5.5 5.9
61 5 1 1 31.89 63.78 1.45807 202.1 2.7 2.5 5.9
62 0 2 4 32.067 64.135 1.45085 113.8 1.5 1.4 5.9
63 5 2 0 32.148 64.295 1.44762 107.0 1.4 1.3 5.9
64 2 4 3 32.661 65.321 1.42734 80.3 1.1 1.0 5.9
65 1 2 4 32.717 65.434 1.42515 185.9 2.4 2.3 5.9
66 3 3 3 32.952 65.905 1.41611 574.9 7.6 7.2 5.9
67 2 6 1 33.019 66.038 1.41358 1121.8 14.7 14.1 5.9
68 5 2 1 33.154 66.307 1.40849 93.7 1.2 1.2 5.9
69 2 1 4 33.393 66.785 1.39956 317.9 4.2 4.0 5.9
70 0 6 2 33.445 66.89 1.39762 178.5 2.3 2.2 5.9
71 0 5 3 33.845 67.689 1.38305 184.6 2.4 2.3 5.9
72 4 1 3 34.103 68.206 1.37383 426.7 5.6 5.3 5.9
73 1 5 3 34.477 68.954 1.36073 366.1 4.8 4.6 5.9
74 3 5 2 34.619 69.239 1.35584 385.5 5.1 4.8 5.9
75 1 3 4 34.784 69.569 1.35021 814.7 10.7 10.2 5.9
76 5 3 1 35.208 70.416 1.33602 700.4 9.2 8.7 5.9
77 0 7 1 35.822 71.645 1.3161 429.2 5.6 5.3 5.9
78 4 5 1 36.074 72.148 1.30815 345.0 4.5 4.3 5.9
79 3 1 4 36.523 73.047 1.29426 169.4 2.2 2.1 6.0
80 5 4 0 37.056 74.111 1.27828 215.1 2.8 2.7 6.0
81 2 7 0 37.324 74.649 1.27041 160.9 2.1 2.0 6.0
82 1 4 4 37.59 75.181 1.26273 293.1 3.9 3.6 6.0
83 3 2 4 37.714 75.428 1.2592 143.4 1.9 1.8 6.0
84 5 4 1 38.002 76.003 1.2511 105.0 1.4 1.3 6.0
85 5 3 2 38.072 76.144 1.24913 617.0 8.1 7.6 6.0
86 6 0 1 38.367 76.735 1.24098 532.0 7.0 6.6 6.0
87 3 5 3 39.379 78.757 1.21411 281.4 3.7 3.4 6.0
88 4 6 0 39.47 78.941 1.21174 189.8 2.5 2.3 6.0
89 0 1 5 39.549 79.098 1.20973 97.3 1.3 1.2 6.0
90 5 1 3 39.622 79.245 1.20786 111.5 1.5 1.4 6.0
91 3 3 4 39.671 79.342 1.20662 209.5 2.8 2.6 6.0
92 6 2 1 39.928 79.855 1.20015 235.6 3.1 2.9 6.0
93 4 0 4 40.359 80.718 1.18948 383.2 5.0 4.7 6.1
94 5 5 0 40.576 81.153 1.1842 121.6 1.6 1.5 6.1
95 2 6 3 40.66 81.32 1.1822 626.2 8.2 7.6 6.1
96 5 4 2 40.798 81.595 1.1789 388.5 5.1 4.7 6.1
97 2 7 2 41.059 82.118 1.17271 318.1 4.2 3.9 6.1
98 1 2 5 41.305 82.61 1.16697 78.8 1.0 1.0 6.1
99 5 5 1 41.499 82.998 1.16249 224.0 2.9 2.7 6.1
100 2 0 5 41.543 83.085 1.1615 632.6 8.3 7.7 6.1
101 4 2 4 41.901 83.802 1.15339 540.2 7.1 6.5 6.1
102 1 8 1 42.291 84.581 1.14473 110.1 1.4 1.3 6.1
103 3 4 4 42.371 84.743 1.14296 100.7 1.3 1.2 6.1
104 5 3 3 42.707 85.413 1.1357 480.5 6.3 5.8 6.1
105 2 5 4 42.871 85.742 1.13218 156.2 2.1 1.9 6.1
106 2 2 5 43.077 86.154 1.12782 270.9 3.6 3.3 6.1
107 4 6 2 43.159 86.318 1.1261 788.6 10.4 9.5 6.1
108 1 3 5 43.223 86.447 1.12475 319.3 4.2 3.8 6.1
109 0 7 3 43.289 86.578 1.12339 156.4 2.1 1.9 6.1
110 4 5 3 43.528 87.057 1.11843 153.6 2.0 1.8 6.1
111 2 8 1 44.058 88.116 1.1077 442.3 5.8 5.3 6.2
112 0 8 2 44.449 88.897 1.09998 363.6 4.8 4.3 6.2
113 0 6 4 44.723 89.445 1.09465 293.0 3.8 3.5 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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