Institute of Experimental Mineralogy
Russian Academy of Sciences
-------------------------------------------------
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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WAYNEBURNHAMITE
1
Pb(9)Ca(6)[Si(2)O(7)](3)[SiO(4)](3)
Hexagonal P 6(-) Z = 1
R =0.0301 NR =1063
8 .11 .16
Ref.Str.:
A.R. Kampf, R.M. Housley, G.R. Rossman (2016)
* Amer. Mineral., 101, 2423-2429
L: $Pb8.3 Sr0.04 Ca5.40 Cu2+0.27 Si9 S0.21 O32.64 Cl0.05$
R: Locality - the Commercial quarry, Crestmore, Riverside County,
California, USA. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 9.8953 alpha = 90.0
b = 9.8953 beta = 90.0
c = 10.2055 gamma = 120.0
Unit cell volume (cub. angs.) = 865.41
Molar volume ( cub.cm/mol.) = 521.27
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.2647 0.2671 0.1797 0.0 Pb = 0.93, Pb = 0.0
2 0.9876 0.2555 0.5 0.0 Pb = 0.93, Pb = 0.0
3 0.3333 0.6667 0.34 0.0 Ca = 0.8 , Cu = 0.2
4 0.3333 0.6667 0.0 0.0 Ca = 1.00
5 0.6667 0.3333 0.3249 0.0 Ca = 1.00
6 0.6667 0.3333 0.0 0.0 Ca = 0.71, Cu = 0.29
7 0.4096 0.3838 0.5 0.0 Si = 1.00
8 0.0239 0.4092 0.1502 0.0 Si = 1.00
9 0.507 0.152 0.1584 0.0 O = 1.00
10 0.074 0.374 0.0 0.0 O = 1.00
11 0.134 0.5994 0.1667 0.0 O = 1.00
12 0.157 0.649 0.5 0.0 O = 1.00
13 0.35 0.265 0.3761 0.0 O = 1.00
14 0.0744 0.319 0.2541 0.0 O = 1.00
15 0.602 0.469 0.5 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.2647 0.2671 0.1797
2 2 0.9876 0.2555 0.5
3 3 0.3333 0.6667 0.34
4 4 0.3333 0.6667 0.0
5 5 0.6667 0.3333 0.3249
6 6 0.6667 0.3333 0.0
7 7 0.4096 0.3838 0.5
8 8 0.0239 0.4092 0.1502
9 9 0.507 0.152 0.1584
10 10 0.074 0.374 0.0
11 11 0.134 0.5994 0.1667
12 12 0.157 0.649 0.5
13 13 0.35 0.265 0.3761
14 14 0.0744 0.319 0.2541
15 15 0.602 0.469 0.5
16 1 0.7329 0.9976 0.1797
17 1 0.0024 0.7353 0.1797
18 2 0.7445 0.732 0.5
19 2 0.268 0.0124 0.5
20 7 0.6162 0.0258 0.5
21 7 0.9742 0.5904 0.5
22 8 0.5908 0.6147 0.1502
23 8 0.3853 0.9761 0.1502
24 9 0.848 0.355 0.1584
25 9 0.645 0.493 0.1584
26 10 0.626 0.7 0.0
27 10 0.3 0.926 0.0
28 11 0.4006 0.5346 0.1667
29 11 0.4654 0.866 0.1667
30 12 0.351 0.508 0.5
31 12 0.492 0.843 0.5
32 13 0.735 0.085 0.3761
33 13 0.915 0.65 0.3761
34 14 0.681 0.7554 0.2541
35 14 0.2446 0.9256 0.2541
36 15 0.531 0.133 0.5
37 15 0.867 0.398 0.5
38 1 0.2647 0.2671 0.8203
39 3 0.3333 0.6667 0.66
40 5 0.6667 0.3333 0.6751
41 8 0.0239 0.4092 0.8498
42 9 0.507 0.152 0.8416
43 11 0.134 0.5994 0.8333
44 13 0.35 0.265 0.6239
45 14 0.0744 0.319 0.7459
46 1 0.7329 0.9976 0.8203
47 1 0.0024 0.7353 0.8203
48 8 0.5908 0.6147 0.8498
49 8 0.3853 0.9761 0.8498
50 9 0.848 0.355 0.8416
51 9 0.645 0.493 0.8416
52 11 0.4006 0.5346 0.8333
53 11 0.4654 0.866 0.8333
54 13 0.735 0.085 0.6239
55 13 0.915 0.65 0.6239
56 14 0.681 0.7554 0.7459
57 14 0.2446 0.9256 0.7459
X-ray density (g/cm cub.) = 5.31
MU (1/cm) = 1276.565 Mass attenuation coefficient (cm**2/g) = 240.625
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Pb ,Pb 3.144 4
3.1345 9
2.1791 13
2.3135 14
2.296 11
2 Pb ,Pb 3.144 5
2.6251 14
2.5446 13
2.2568 15
2.6251 14
2.5446 13
3 Ca ,Cu 2.88 6
2.4794 11
2.3313 12
2.4801 11
2.4795 11
2.332 12
2.3316 12
4 Ca 2.88 9
2.7461 10
2.4318 11
2.7465 10
2.7454 10
2.4326 11
2.432 11
2.4318 11
2.4326 11
2.432 11
5 Ca 2.88 6
2.4017 9
2.5032 15
2.4014 9
2.4021 9
2.5027 15
2.5026 15
6 Ca ,Cu 2.88 6
2.3439 9
2.3437 9
2.3443 9
2.3439 9
2.3437 9
2.3443 9
7 Si 2.1 4
1.6234 13
1.6524 15
1.5997 12
1.6234 13
8 Si 2.1 4
1.6998 10
1.6453 11
1.6176 14
1.5462 9
9 O 3.264 7
3.2151 13
2.9399 9
2.9399 9
2.6887 10
2.6497 11
2.6263 14
3.2331 9
10 O 3.264 6
2.6263 11
2.6501 14
2.6887 9
2.6263 11
2.6501 14
2.6887 9
11 O 3.264 7
2.6263 10
2.6843 14
2.6497 9
3.0104 11
3.0104 11
3.2555 13
2.9799 14
12 O 3.264 5
2.8828 12
2.8828 12
2.7123 13
2.6974 15
2.7123 13
13 O 3.264 7
3.2151 9
2.6188 15
3.2555 11
2.7123 12
3.2272 14
2.9753 15
2.5289 13
14 O 3.264 5
2.6501 10
2.6843 11
2.6263 9
2.9799 11
3.2272 13
15 O 3.264 7
2.6188 13
2.6974 12
2.9753 13
3.0352 15
3.0352 15
2.6188 13
2.9753 13
X-ray diffraction powder data (II), X-Ray W.L. = 1.78892(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 0 0 1 5.028 10.056 0.049 257.38 2 33.9 78.8
2 1 0 0 5.991 11.982 0.058 180.61 6 58.6 496.2
3 1 0 1 7.833 15.667 0.076 104.72 12 25.0 105.0
4 0 0 2 10.096 20.191 0.098 62.18 2 60.3 60.3
5 1 1 0 10.415 20.831 0.101 58.28 6 245.6 2815.9
6 1 1 1 11.59 23.18 0.112 46.66 12 190.4 2710.0
7 1 0 2 11.772 23.543 0.114 45.17 12 28.5 58.8
8 2 0 0 12.049 24.098 0.117 43.02 6 203.8 1431.3
9 2 0 1 13.086 26.171 0.127 36.16 12 62.4 225.8
10 1 1 2 14.585 29.17 0.141 28.72 12 287.6 3806.4
11 0 0 3 15.244 30.489 0.147 26.12 2 664.1 3076.8
12 2 0 2 15.818 31.637 0.152 24.13 12 52.3 105.8
13 1 2 0 16.031 32.062 0.154 23.44 6 243.7 1115.7
14 2 1 0 16.031 32.062 0.154 23.44 6 248.9 1163.6
15 1 0 3 16.433 32.866 0.158 22.22 12 151.7 819.1
16 1 2 1 16.842 33.683 0.162 21.07 12 243.9 2007.6
17 2 1 1 16.842 33.683 0.162 21.07 12 266.4 2395.4
18 3 0 0 18.248 36.496 0.175 17.68 6 445.3 2809.1
19 1 1 3 18.608 37.216 0.178 16.94 12 347.9 3284.3
20 3 0 1 18.975 37.951 0.182 16.22 12 31.8 26.2
21 1 2 2 19.092 38.184 0.183 16.0 12 281.1 2025.5
22 2 1 2 19.092 38.184 0.183 16.0 12 270.8 1879.9
23 2 0 3 19.617 39.233 0.188 15.07 12 61.2 90.5
24 0 0 4 20.523 41.046 0.196 13.63 2 114.0 47.3
25 3 0 2 21.03 42.06 0.201 12.91 12 52.8 57.7
26 2 2 0 21.197 42.393 0.202 12.68 6 157.3 251.3
27 1 0 4 21.456 42.912 0.204 12.34 12 42.2 35.2
28 2 2 1 21.842 43.683 0.208 11.85 12 54.3 56.1
29 1 3 0 22.107 44.214 0.21 11.54 6 240.2 533.1
30 3 1 0 22.107 44.214 0.21 11.54 6 150.4 209.0
31 1 2 3 22.415 44.829 0.213 11.18 12 198.1 702.9
32 2 1 3 22.415 44.829 0.213 11.18 12 133.1 317.6
33 1 3 1 22.731 45.462 0.216 10.83 12 89.8 139.9
34 3 1 1 22.731 45.462 0.216 10.83 12 38.8 26.1
35 1 1 4 23.232 46.463 0.22 10.31 12 187.2 578.8
36 2 2 2 23.692 47.384 0.225 9.86 12 86.9 119.3
37 2 0 4 24.081 48.162 0.228 9.51 12 60.1 55.0
38 3 0 3 24.135 48.269 0.229 9.46 12 179.8 490.1
39 1 3 2 24.529 49.058 0.232 9.12 12 112.2 183.9
40 3 1 2 24.529 49.058 0.232 9.12 12 33.6 16.5
41 4 0 0 24.677 49.354 0.233 8.99 6 431.3 1340.1
42 4 0 1 25.252 50.505 0.238 8.53 12 35.4 17.1
43 0 0 5 25.991 51.981 0.245 7.99 2 111.0 26.3
44 1 2 4 26.505 53.011 0.249 7.64 12 207.9 529.1
45 2 1 4 26.505 53.011 0.249 7.64 12 191.9 451.1
46 2 2 3 26.556 53.111 0.25 7.61 12 309.6 1168.9
47 1 0 5 26.775 53.549 0.252 7.47 12 36.3 15.7
48 4 0 2 26.924 53.848 0.253 7.37 12 58.8 40.9
49 2 3 0 27.063 54.125 0.254 7.29 6 316.5 585.0
50 3 2 0 27.063 54.125 0.254 7.29 6 202.4 239.3
51 1 3 3 27.328 54.657 0.257 7.13 12 221.0 558.0
52 3 1 3 27.328 54.657 0.257 7.13 12 272.8 849.7
53 2 3 1 27.602 55.204 0.259 6.97 12 275.3 845.9
54 3 2 1 27.602 55.204 0.259 6.97 12 197.4 435.1
55 3 0 4 28.038 56.076 0.263 6.72 12 57.6 35.8
56 1 1 5 28.298 56.595 0.265 6.59 12 325.5 1118.0
57 1 4 0 28.575 57.15 0.267 6.44 6 108.9 61.2
58 4 1 0 28.575 57.15 0.267 6.44 6 191.1 188.4
59 2 0 5 29.039 58.078 0.271 6.21 12 53.1 28.0
60 1 4 1 29.096 58.192 0.272 6.18 12 25.4 6.4
61 4 1 1 29.096 58.192 0.272 6.18 12 59.4 35.0
62 2 3 2 29.181 58.361 0.273 6.14 12 288.7 820.2
63 3 2 2 29.181 58.361 0.273 6.14 12 247.5 602.8
64 4 0 3 29.564 59.129 0.276 5.97 12 495.8 2349.4
65 2 2 4 30.24 60.48 0.282 5.67 12 65.4 38.8
66 1 4 2 30.625 61.25 0.285 5.51 12 39.6 13.9
67 4 1 2 30.625 61.25 0.285 5.51 12 84.0 62.3
68 1 3 4 30.953 61.905 0.288 5.39 12 96.9 81.0
69 3 1 4 30.953 61.905 0.288 5.39 12 97.6 82.2
70 1 2 5 31.197 62.393 0.29 5.29 12 286.4 695.6
71 2 1 5 31.197 62.393 0.29 5.29 12 283.5 681.7
72 5 0 0 31.458 62.917 0.292 5.2 6 7.2 0.2
73 2 3 3 31.7 63.401 0.294 5.11 12 197.3 318.6
74 3 2 3 31.7 63.401 0.294 5.11 12 135.7 150.8
75 0 0 6 31.727 63.454 0.294 5.1 2 680.8 631.2
76 5 0 1 31.951 63.901 0.296 5.02 12 75.5 45.9
77 1 0 6 32.42 64.841 0.3 4.87 12 47.8 17.8
78 3 0 5 32.588 65.177 0.301 4.81 12 74.5 42.7
79 3 3 0 32.844 65.688 0.303 4.73 6 80.4 24.5
80 4 0 4 33.037 66.073 0.305 4.67 12 108.2 87.6
81 1 4 3 33.081 66.161 0.305 4.66 12 63.6 30.2
82 4 1 3 33.081 66.161 0.305 4.66 12 40.9 12.5
83 3 3 1 33.325 66.65 0.307 4.59 12 165.8 202.1
84 5 0 2 33.404 66.807 0.308 4.57 12 64.5 30.4
85 2 4 0 33.525 67.051 0.309 4.53 6 244.0 216.1
86 4 2 0 33.525 67.051 0.309 4.53 6 214.6 167.2
87 1 1 6 33.785 67.57 0.311 4.46 12 151.1 163.2
88 2 4 1 34.002 68.003 0.313 4.4 12 69.4 33.9
89 4 2 1 34.002 68.003 0.313 4.4 12 130.1 119.3
90 2 0 6 34.457 68.914 0.316 4.28 12 132.6 120.6
91 2 2 5 34.62 69.24 0.318 4.24 12 104.5 74.2
92 3 3 2 34.749 69.497 0.319 4.21 12 197.1 261.9
93 2 3 4 35.055 70.111 0.321 4.13 12 138.4 126.9
94 3 2 4 35.055 70.111 0.321 4.13 12 173.8 200.1
95 1 3 5 35.285 70.569 0.323 4.08 12 111.2 80.8
96 3 1 5 35.285 70.569 0.323 4.08 12 50.2 16.4
97 2 4 2 35.412 70.825 0.324 4.05 12 65.1 27.5
98 4 2 2 35.412 70.825 0.324 4.05 12 154.8 155.5
99 1 5 0 35.531 71.062 0.325 4.02 6 273.6 241.1
100 5 1 0 35.531 71.062 0.325 4.02 6 337.5 367.1
101 5 0 3 35.759 71.518 0.327 3.97 12 115.8 85.3
102 1 5 1 35.995 71.99 0.329 3.92 12 231.5 336.6
103 5 1 1 35.995 71.99 0.329 3.92 12 264.0 437.6
104 1 4 4 36.373 72.745 0.332 3.84 12 9.8 0.6
105 4 1 4 36.373 72.745 0.332 3.84 12 49.9 15.3
106 1 2 6 36.439 72.878 0.332 3.83 12 201.8 249.8
107 2 1 6 36.439 72.878 0.332 3.83 12 163.0 163.0
108 3 3 3 37.066 74.131 0.337 3.71 12 137.9 113.0
109 4 0 5 37.248 74.496 0.338 3.67 12 94.0 52.0
110 1 5 2 37.373 74.746 0.339 3.65 12 302.6 535.8
111 5 1 2 37.373 74.746 0.339 3.65 12 283.4 469.8
112 2 4 3 37.713 75.425 0.342 3.59 12 150.1 129.8
113 4 2 3 37.713 75.425 0.342 3.59 12 192.3 212.9
114 3 0 6 37.737 75.474 0.342 3.59 12 305.9 538.0
115 0 0 7 37.844 75.688 0.343 3.57 2 149.9 21.4
116 1 0 7 38.486 76.973 0.348 3.47 12 58.5 19.0
117 6 0 0 38.775 77.549 0.35 3.42 6 56.1 8.6
118 5 0 4 38.954 77.909 0.351 3.4 12 7.4 0.3
119 2 3 5 39.175 78.35 0.353 3.36 12 303.8 497.5
120 3 2 5 39.175 78.35 0.353 3.36 12 281.2 426.1
121 6 0 1 39.224 78.449 0.353 3.36 12 62.1 20.8
122 3 4 0 39.412 78.824 0.355 3.33 6 322.3 277.3
123 4 3 0 39.412 78.824 0.355 3.33 6 164.5 72.2
124 1 5 3 39.632 79.264 0.357 3.3 12 211.6 236.9
125 5 1 3 39.632 79.264 0.357 3.3 12 268.1 380.3
126 2 2 6 39.656 79.312 0.357 3.3 12 123.4 80.4
127 1 1 7 39.762 79.523 0.358 3.29 12 69.3 25.3
128 3 4 1 39.86 79.72 0.358 3.27 12 27.3 3.9
129 4 3 1 39.86 79.72 0.358 3.27 12 20.2 2.1
130 3 3 4 40.225 80.451 0.361 3.23 12 97.0 48.7
131 1 3 6 40.29 80.58 0.361 3.22 12 108.6 60.8
132 3 1 6 40.29 80.58 0.361 3.22 12 152.6 120.1
133 2 0 7 40.395 80.79 0.362 3.21 12 84.8 37.0
134 1 4 5 40.444 80.889 0.363 3.2 12 37.1 7.1
135 4 1 5 40.444 80.889 0.363 3.2 12 64.7 21.5
136 6 0 2 40.566 81.132 0.364 3.19 12 79.8 32.5
137 2 5 0 40.68 81.359 0.364 3.17 6 71.7 13.1
138 5 2 0 40.68 81.359 0.364 3.17 6 58.9 8.8
139 2 4 4 40.857 81.715 0.366 3.15 12 76.9 29.9
140 4 2 4 40.857 81.715 0.366 3.15 12 122.0 75.3
141 2 5 1 41.124 82.249 0.368 3.12 12 114.2 65.3
142 5 2 1 41.124 82.249 0.368 3.12 12 171.6 147.3
143 3 4 2 41.197 82.394 0.368 3.12 12 14.1 1.0
144 4 3 2 41.197 82.394 0.368 3.12 12 75.5 28.5
145 4 0 6 42.179 84.359 0.375 3.02 12 338.8 555.9
146 1 2 7 42.284 84.567 0.376 3.01 12 111.9 60.5
147 2 1 7 42.284 84.567 0.376 3.01 12 137.7 91.5
148 2 5 2 42.453 84.906 0.377 3.0 12 141.9 96.7
149 5 2 2 42.453 84.906 0.377 3.0 12 211.8 215.5
150 1 5 4 42.742 85.484 0.379 2.97 12 161.7 124.7
151 5 1 4 42.742 85.484 0.379 2.97 12 175.9 147.4
152 6 0 3 42.782 85.565 0.38 2.97 12 165.9 131.1
153 5 0 5 42.959 85.917 0.381 2.96 12 47.5 10.7
154 1 6 0 43.192 86.383 0.383 2.94 6 150.9 53.6
155 6 1 0 43.192 86.383 0.383 2.94 6 103.0 25.0
156 3 4 3 43.408 86.816 0.384 2.92 12 394.8 730.3
157 4 3 3 43.408 86.816 0.384 2.92 12 218.3 223.3
158 3 0 7 43.535 87.071 0.385 2.91 12 71.6 23.9
159 1 6 1 43.632 87.265 0.386 2.91 12 123.0 70.5
160 6 1 1 43.632 87.265 0.386 2.91 12 86.1 34.5
161 2 3 6 44.056 88.113 0.389 2.88 12 232.5 249.5
162 3 2 6 44.056 88.113 0.389 2.88 12 149.6 103.3
163 3 3 5 44.209 88.417 0.39 2.87 12 179.0 147.4
164 0 0 8 44.52 89.04 0.392 2.85 2 39.9 1.2
165 2 5 3 44.657 89.314 0.393 2.85 12 191.1 166.6
166 5 2 3 44.657 89.314 0.393 2.85 12 149.0 101.3
167 2 4 5 44.833 89.666 0.394 2.84 12 77.5 27.3
168 4 2 5 44.833 89.666 0.394 2.84 12 152.1 105.1
169 1 6 2 44.953 89.907 0.395 2.83 12 145.9 96.5
170 6 1 2 44.953 89.907 0.395 2.83 12 116.2 61.2
X-ray diffraction powder data (I)...X-Ray wave length = 1.78892 (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 5.028 10.056 10.2055 78.8 1.8 1.8 5.6
2 1 0 0 5.991 11.982 8.56958 496.2 11.3 11.4 5.6
3 1 0 1 7.833 15.667 6.56273 105.0 2.4 2.4 5.6
4 0 0 2 10.096 20.191 5.10275 60.3 1.4 1.4 5.6
5 1 1 0 10.415 20.831 4.94765 2815.9 64.0 64.6 5.6
6 1 1 1 11.59 23.18 4.45205 2710.0 61.5 62.1 5.6
7 1 0 2 11.772 23.543 4.38435 58.8 1.3 1.3 5.6
8 2 0 0 12.049 24.098 4.28479 1431.3 32.5 32.8 5.6
9 2 0 1 13.086 26.171 3.95071 225.8 5.1 5.2 5.6
10 1 1 2 14.585 29.17 3.55208 3806.4 86.5 86.8 5.6
11 0 0 3 15.244 30.489 3.40183 3076.8 69.9 70.1 5.6
12 2 0 2 15.818 31.637 3.28137 105.8 2.4 2.4 5.6
13 2 1 0 16.031 32.062 3.239 2279.3 51.8 51.8 5.6
14 1 0 3 16.433 32.866 3.16182 819.1 18.6 18.6 5.6
15 2 1 1 16.842 33.683 3.08724 4403.0 100.0 100.0 5.7
16 3 0 0 18.248 36.496 2.85653 2809.1 63.8 63.6 5.7
17 1 1 3 18.608 37.216 2.80317 3284.3 74.6 74.4 5.7
18 1 2 2 19.092 38.184 2.73461 3905.4 88.7 88.3 5.7
19 2 0 3 19.617 39.233 2.66425 90.5 2.1 2.0 5.7
20 0 0 4 20.523 41.046 2.55138 47.3 1.1 1.1 5.7
21 3 0 2 21.03 42.06 2.49255 57.7 1.3 1.3 5.7
22 2 2 0 21.197 42.393 2.47382 251.3 5.7 5.7 5.7
23 2 2 1 21.842 43.683 2.4042 56.1 1.3 1.3 5.7
24 1 3 0 22.107 44.214 2.37677 742.1 16.9 16.7 5.7
25 1 2 3 22.415 44.829 2.34577 1020.5 23.2 22.9 5.7
26 1 3 1 22.731 45.462 2.31483 166.0 3.8 3.7 5.7
27 1 1 4 23.232 46.463 2.26762 578.8 13.1 13.0 5.7
28 2 2 2 23.692 47.384 2.22602 119.3 2.7 2.7 5.7
29 2 0 4 24.081 48.162 2.19217 55.0 1.2 1.2 5.7
30 3 0 3 24.135 48.269 2.18758 490.1 11.1 11.0 5.7
31 1 3 2 24.529 49.058 2.15452 200.4 4.6 4.5 5.7
32 4 0 0 24.677 49.354 2.1424 1340.1 30.4 29.9 5.7
33 1 2 4 26.505 53.011 2.00425 980.2 22.3 21.8 5.8
34 2 2 3 26.556 53.111 2.00074 1168.9 26.5 26.0 5.8
35 2 3 0 27.063 54.125 1.966 824.2 18.7 18.3 5.8
36 3 1 3 27.328 54.657 1.94834 1407.7 32.0 31.2 5.8
37 2 3 1 27.602 55.204 1.9305 1281.0 29.1 28.4 5.8
38 1 1 5 28.298 56.595 1.88685 1118.0 25.4 24.8 5.8
39 4 1 0 28.575 57.15 1.87004 249.6 5.7 5.5 5.8
40 2 3 2 29.181 58.361 1.83454 1423.0 32.3 31.4 5.8
41 4 0 3 29.564 59.129 1.81284 2349.4 53.4 51.8 5.8
42 4 1 2 30.625 61.25 1.75584 76.2 1.7 1.7 5.8
43 3 1 4 30.953 61.905 1.73909 163.3 3.7 3.6 5.8
44 1 2 5 31.197 62.393 1.72683 1377.3 31.3 30.2 5.8
45 0 0 6 31.727 63.454 1.70092 1100.7 25.0 24.1 5.9
46 5 0 1 31.951 63.901 1.69025 45.9 1.0 1.0 5.9
47 4 0 4 33.037 66.073 1.64068 87.6 2.0 1.9 5.9
48 3 3 1 33.325 66.65 1.6281 202.1 4.6 4.4 5.9
49 2 4 0 33.525 67.051 1.6195 383.3 8.7 8.4 5.9
50 1 1 6 33.785 67.57 1.60852 163.2 3.7 3.6 5.9
51 4 2 1 34.002 68.003 1.59948 153.2 3.5 3.3 5.9
52 2 0 6 34.457 68.914 1.58091 120.6 2.7 2.6 5.9
53 2 2 5 34.62 69.24 1.57439 74.2 1.7 1.6 5.9
54 3 3 2 34.749 69.497 1.56929 261.9 5.9 5.7 5.9
55 3 2 4 35.055 70.111 1.55729 326.9 7.4 7.1 5.9
56 1 3 5 35.285 70.569 1.54847 97.2 2.2 2.1 5.9
57 4 2 2 35.412 70.825 1.54362 183.0 4.2 4.0 5.9
58 5 1 0 35.531 71.062 1.53914 608.2 13.8 13.2 5.9
59 5 0 3 35.759 71.518 1.53063 85.3 1.9 1.8 5.9
60 5 1 1 35.995 71.99 1.52193 774.3 17.6 16.7 5.9
61 1 2 6 36.439 72.878 1.5059 412.8 9.4 8.9 6.0
62 3 3 3 37.066 74.131 1.48402 113.0 2.6 2.4 6.0
63 4 0 5 37.248 74.496 1.47779 52.0 1.2 1.1 6.0
64 1 5 2 37.373 74.746 1.47357 1005.6 22.8 21.6 6.0
65 3 0 6 37.737 75.474 1.46145 880.6 20.0 18.9 6.0
66 2 3 5 39.175 78.35 1.41598 923.7 21.0 19.7 6.0
67 3 4 0 39.412 78.824 1.40883 349.5 7.9 7.4 6.0
68 5 1 3 39.632 79.264 1.40229 697.7 15.8 14.8 6.0
69 3 3 4 40.225 80.451 1.38505 48.7 1.1 1.0 6.0
70 3 1 6 40.29 80.58 1.38321 180.9 4.1 3.8 6.1
71 4 2 4 40.857 81.715 1.3673 105.1 2.4 2.2 6.1
72 5 2 1 41.124 82.249 1.35999 212.7 4.8 4.5 6.1
73 4 0 6 42.179 84.359 1.33213 555.9 12.6 11.7 6.1
74 2 1 7 42.284 84.567 1.32946 151.9 3.5 3.2 6.1
75 5 2 2 42.453 84.906 1.32515 312.1 7.1 6.6 6.1
76 5 1 4 42.742 85.484 1.3179 272.1 6.2 5.7 6.1
77 6 0 3 42.782 85.565 1.3169 131.1 3.0 2.7 6.1
78 1 6 0 43.192 86.383 1.30685 78.6 1.8 1.6 6.1
79 3 4 3 43.408 86.816 1.30162 953.6 21.7 19.9 6.1
80 1 6 1 43.632 87.265 1.29626 105.0 2.4 2.2 6.2
81 2 3 6 44.056 88.113 1.28632 352.8 8.0 7.3 6.2
82 3 3 5 44.209 88.417 1.2828 147.4 3.3 3.1 6.2
83 2 5 3 44.657 89.314 1.2726 267.9 6.1 5.6 6.2
84 4 2 5 44.833 89.666 1.26866 132.4 3.0 2.7 6.2
85 1 6 2 44.953 89.907 1.26599 157.7 3.6 3.3 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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