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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BRABANTITE
1, f-monazite
CaTh[PO(4)](2)
Monoclinic P 2(1)/n Z = 2
P2(1)/n
17 .8 .1990
Ref.Str.:
Finney J.J., Rao N.N. (1967)
* Amer. Mineral., 52, 13-19
Ref.Composition & Lattice:
Rose D.(1980)
* Neues Jb. Miner., Mh., H 6, 247-257
Reserv:
The coordinates of atoms are from cheralite
A wet chemical analisis gives
[Ca(1.0)Mg(0.065)Al(0.068)Mn(0.021)]Th(0.936)[P(1.832)Si(0.177)]O(8)
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 6.726 alpha = 90.0
b = 6.933 beta = 103.88
c = 6.447 gamma = 90.0
Unit cell volume (cub. angs.) = 291.85
Molar volume ( cub.cm/mol.) = 87.9
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.2198 0.1596 0.3991 0.0 Ca = 0.5 , Th = 0.5
2 0.196 0.163 0.8858 0.0 P = 0.92, Si = 0.09
3 0.2473 0.5064 0.4426 0.0 O = 1.00
4 0.0238 0.1044 0.6906 0.0 O = 1.00
5 0.374 0.2221 0.7898 0.0 O = 1.00
6 0.1114 0.3337 0.9989 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.2198 0.1596 0.3991
2 2 0.196 0.163 0.8858
3 3 0.2473 0.5064 0.4426
4 4 0.0238 0.1044 0.6906
5 5 0.374 0.2221 0.7898
6 6 0.1114 0.3337 0.9989
7 1 0.7802 0.8404 0.6009
8 2 0.804 0.837 0.1142
9 3 0.7527 0.4936 0.5574
10 4 0.9762 0.8956 0.3094
11 5 0.626 0.7779 0.2102
12 6 0.8886 0.6663 0.0011
13 1 0.7198 0.3404 0.8991
14 2 0.696 0.337 0.3858
15 3 0.7473 0.9936 0.9426
16 4 0.5238 0.3956 0.1906
17 5 0.874 0.2779 0.2898
18 6 0.6114 0.1663 0.4989
19 1 0.2802 0.6596 0.1009
20 2 0.304 0.663 0.6142
21 3 0.2527 0.0064 0.0574
22 4 0.4762 0.6044 0.8094
23 5 0.126 0.7221 0.7102
24 6 0.3886 0.8337 0.5011
X-ray density (g/cm cub.) = 5.25
MU (1/cm) = 1004.811 Mass attenuation coefficient (cm**2/g) = 191.372
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca ,Th 2.928 9
2.4226 3
2.57 4
2.5208 5
2.7826 6
2.432 4
2.4068 5
2.5574 6
2.5028 3
2.5433 6
2 P ,Si 2.232 4
1.5463 4
1.5296 5
1.5669 6
1.5316 3
3 O 3.264 8
2.9507 5
3.0327 6
3.2545 4
2.8527 4
2.9322 5
2.584 4
2.56 5
2.4541 6
4 O 3.264 9
2.429 5
2.5026 6
3.2545 3
2.8036 4
2.8527 3
2.8089 5
2.7858 6
2.584 3
2.7335 5
5 O 3.264 8
2.9507 3
2.429 4
2.5842 6
2.9322 3
2.8089 4
2.7665 6
2.56 3
2.7335 4
6 O 3.264 7
3.0327 3
2.5026 4
2.5842 5
2.752 6
2.7858 4
2.7665 5
2.4541 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 0 -1 8.549 17.098 0.096 87.57 2 55.7 638.4
2 1 1 0 9.326 18.652 0.105 73.23 4 36.1 448.3
3 0 1 1 9.544 19.088 0.108 69.83 4 56.9 1062.8
4 1 1 -1 10.695 21.39 0.12 55.17 4 85.0 1870.7
5 1 0 1 10.942 21.884 0.123 52.61 2 74.0 677.0
6 1 1 1 12.705 25.411 0.143 38.48 4 62.0 693.8
7 0 2 0 12.839 25.677 0.144 37.64 2 103.6 949.2
8 2 0 0 13.647 27.293 0.153 33.09 2 200.9 3134.1
9 0 0 2 14.25 28.499 0.16 30.18 2 63.0 281.4
10 1 2 0 14.571 29.142 0.163 28.78 4 194.4 5105.2
11 0 2 1 14.715 29.43 0.165 28.18 4 38.4 195.4
12 2 1 0 15.117 30.233 0.169 26.6 4 80.5 808.6
13 2 1 -1 15.254 30.509 0.171 26.09 4 34.7 147.6
14 1 2 -1 15.506 31.013 0.174 25.19 4 8.4 8.3
15 1 1 -2 15.666 31.332 0.175 24.64 4 107.9 1346.6
16 0 1 2 15.668 31.335 0.175 24.63 4 179.5 3727.9
17 1 2 1 16.992 33.984 0.19 20.66 4 5.5 3.0
18 2 0 -2 17.296 34.592 0.193 19.88 2 153.5 1099.4
19 2 1 1 18.155 36.31 0.202 17.88 4 16.3 22.2
20 2 1 -2 18.505 37.01 0.206 17.14 4 107.4 928.0
21 1 1 2 18.509 37.018 0.206 17.13 4 76.5 470.6
22 2 2 0 18.911 37.822 0.21 16.34 4 62.0 295.0
23 2 2 -1 19.024 38.049 0.212 16.13 4 33.0 82.7
24 1 2 -2 19.365 38.73 0.215 15.51 4 53.3 206.8
25 0 2 2 19.366 38.733 0.215 15.51 4 4.1 1.2
26 3 0 -1 20.223 40.447 0.224 14.08 2 65.5 141.9
27 1 3 0 20.706 41.412 0.23 13.36 4 28.8 51.9
28 0 3 1 20.812 41.624 0.231 13.21 4 140.1 1217.1
29 1 0 -3 21.078 42.156 0.233 12.84 2 195.2 1148.8
30 3 1 -1 21.291 42.581 0.236 12.55 4 143.8 1219.7
31 1 3 -1 21.405 42.81 0.237 12.4 4 10.6 6.6
32 2 2 1 21.483 42.966 0.238 12.3 4 128.6 955.3
33 3 1 0 21.773 43.546 0.241 11.94 4 40.9 93.6
34 2 2 -2 21.788 43.575 0.241 11.92 4 26.9 40.4
35 1 2 2 21.791 43.583 0.241 11.92 4 8.5 4.0
36 1 1 -3 22.112 44.223 0.244 11.53 4 19.7 20.9
37 2 0 2 22.31 44.621 0.246 11.3 2 5.5 0.8
38 1 3 1 22.555 45.11 0.249 11.03 4 42.7 94.5
39 0 1 3 22.679 45.358 0.25 10.89 4 27.6 39.0
40 3 1 -2 23.294 46.589 0.257 10.25 4 46.7 104.9
41 2 1 2 23.3 46.6 0.257 10.24 4 196.9 1864.4
42 3 0 1 23.679 47.358 0.261 9.88 2 124.0 356.7
43 2 1 -3 23.776 47.552 0.262 9.79 4 3.7 0.6
44 2 3 0 24.102 48.204 0.265 9.49 4 30.4 41.1
45 2 3 -1 24.195 48.391 0.266 9.4 4 130.3 749.5
46 3 2 -1 24.264 48.528 0.267 9.34 4 13.5 7.9
47 1 0 3 24.437 48.873 0.269 9.19 2 99.2 212.4
48 1 3 -2 24.477 48.954 0.269 9.16 4 195.3 1640.7
49 0 3 2 24.478 48.956 0.269 9.16 4 1.6 0.1
50 3 1 1 24.626 49.252 0.27 9.03 4 44.3 83.4
51 3 2 0 24.701 49.401 0.271 8.97 4 138.0 802.3
52 1 2 -3 25.008 50.017 0.274 8.72 4 51.0 106.4
53 1 1 3 25.363 50.725 0.278 8.45 4 37.7 56.3
54 0 2 3 25.526 51.053 0.28 8.33 4 116.8 533.8
55 3 2 -2 26.091 52.181 0.285 7.92 4 165.5 1018.4
56 2 2 2 26.096 52.192 0.286 7.92 4 24.0 21.4
57 2 3 1 26.266 52.532 0.287 7.8 4 76.6 214.7
58 0 4 0 26.386 52.772 0.288 7.72 2 111.4 225.2
59 3 0 -3 26.485 52.969 0.289 7.66 2 119.5 256.9
60 2 3 -2 26.528 53.056 0.29 7.63 4 42.3 64.1
61 1 3 2 26.531 53.063 0.29 7.62 4 184.0 1211.7
62 2 2 -3 26.534 53.068 0.29 7.62 4 92.2 304.4
63 3 2 1 27.322 54.643 0.298 7.13 4 44.5 66.2
64 3 1 -3 27.361 54.721 0.298 7.11 4 12.2 5.0
65 1 4 0 27.374 54.749 0.298 7.1 4 133.3 592.1
66 0 4 1 27.461 54.921 0.299 7.05 4 44.5 65.5
67 1 4 -1 27.944 55.889 0.304 6.78 4 37.9 45.7
68 1 2 3 28.007 56.015 0.305 6.74 4 27.3 23.6
69 4 1 -1 28.13 56.26 0.306 6.67 4 51.9 84.5
70 4 0 0 28.156 56.311 0.306 6.66 2 112.1 196.6
71 4 0 -2 28.489 56.978 0.31 6.49 2 170.5 442.5
72 3 3 -1 28.698 57.397 0.312 6.38 4 13.3 5.3
73 1 4 1 28.898 57.796 0.314 6.28 4 48.7 69.9
74 4 1 0 28.998 57.995 0.315 6.23 4 102.9 309.6
75 3 3 0 29.088 58.176 0.316 6.19 4 88.7 228.4
76 4 1 -2 29.325 58.65 0.318 6.08 4 48.7 67.6
77 3 1 2 29.332 58.664 0.318 6.07 4 84.4 203.1
78 1 3 -3 29.363 58.726 0.318 6.06 4 1.6 0.1
79 1 1 -4 29.384 58.768 0.318 6.05 4 56.5 90.8
80 2 0 -4 29.487 58.974 0.32 6.0 2 83.0 97.0
81 0 0 4 29.491 58.982 0.32 6.0 2 124.8 219.3
82 2 1 3 29.743 59.486 0.322 5.89 4 30.8 26.2
83 0 3 3 29.829 59.658 0.323 5.85 4 5.0 0.7
84 3 2 -3 29.884 59.769 0.323 5.82 4 39.0 41.6
85 2 4 0 30.209 60.418 0.327 5.68 4 72.0 138.3
86 2 4 -1 30.289 60.578 0.327 5.65 4 4.3 0.5
87 2 1 -4 30.306 60.611 0.328 5.64 4 109.4 317.2
88 0 1 4 30.31 60.619 0.328 5.64 4 72.8 140.4
89 3 3 -2 30.339 60.677 0.328 5.63 4 112.5 334.9
90 2 3 2 30.344 60.687 0.328 5.63 4 14.2 5.4
91 1 4 -2 30.531 61.063 0.33 5.55 4 50.3 66.0
92 0 4 2 30.532 61.065 0.33 5.55 4 27.0 19.1
93 4 2 -1 30.613 61.226 0.331 5.52 4 3.4 0.3
94 2 3 -3 30.741 61.483 0.332 5.47 4 9.0 2.1
95 4 2 0 31.438 62.875 0.339 5.2 4 8.0 1.6
96 3 3 1 31.46 62.92 0.339 5.2 4 1.2 0.0
97 4 2 -2 31.75 63.5 0.342 5.09 4 61.3 89.9
98 3 2 2 31.757 63.513 0.342 5.09 4 44.1 46.4
99 1 2 -4 31.806 63.612 0.342 5.07 4 102.8 251.6
100 4 1 1 31.821 63.642 0.342 5.07 4 0.3 0.0
101 1 3 3 32.09 64.18 0.345 4.98 4 28.2 18.5
102 2 4 1 32.091 64.182 0.345 4.98 4 70.1 114.8
103 2 2 3 32.149 64.298 0.345 4.96 4 87.4 177.7
104 2 4 -2 32.323 64.646 0.347 4.9 4 70.2 113.4
105 1 4 2 32.326 64.651 0.347 4.9 4 9.6 2.1
106 4 1 -3 32.44 64.879 0.348 4.86 4 8.3 1.6
107 2 2 -4 32.688 65.375 0.351 4.78 4 34.0 25.9
108 0 2 4 32.692 65.383 0.351 4.78 4 50.6 57.5
109 3 1 -4 32.982 65.965 0.353 4.69 4 73.4 118.6
110 1 1 4 32.99 65.98 0.353 4.69 4 9.6 2.0
111 3 3 -3 33.831 67.663 0.361 4.44 4 14.4 4.3
112 4 2 1 34.145 68.29 0.364 4.36 4 84.4 146.0
113 3 4 -1 34.265 68.531 0.365 4.33 4 14.2 4.1
114 4 3 -1 34.514 69.028 0.368 4.26 4 113.6 258.5
115 1 5 0 34.604 69.208 0.369 4.24 4 13.7 3.7
116 3 4 0 34.619 69.237 0.369 4.24 4 105.8 222.9
117 0 5 1 34.68 69.359 0.369 4.22 4 9.6 1.8
118 3 0 3 34.711 69.422 0.37 4.22 2 85.6 72.5
119 4 2 -3 34.742 69.485 0.37 4.21 4 90.5 161.8
120 1 4 -3 34.869 69.738 0.371 4.18 4 62.6 76.9
121 5 0 -1 34.953 69.907 0.372 4.16 2 24.1 5.6
122 1 5 -1 35.104 70.208 0.373 4.12 4 77.8 117.1
123 3 2 -4 35.267 70.535 0.375 4.08 4 55.9 59.9
124 1 2 4 35.275 70.55 0.375 4.08 4 160.5 493.3
125 4 3 0 35.29 70.58 0.375 4.08 4 7.8 1.2
126 0 4 3 35.294 70.589 0.375 4.08 4 76.9 113.2
127 3 1 3 35.463 70.926 0.377 4.04 4 44.6 37.7
128 4 3 -2 35.585 71.17 0.378 4.01 4 1.9 0.1
129 3 3 2 35.591 71.183 0.378 4.01 4 157.9 469.2
130 4 0 2 35.606 71.213 0.378 4.0 2 93.5 82.3
131 1 3 -4 35.638 71.276 0.378 4.0 4 134.6 340.2
132 5 1 -1 35.703 71.406 0.379 3.98 4 85.9 137.9
133 3 4 -2 35.762 71.524 0.379 3.97 4 106.3 210.9
134 2 4 2 35.766 71.533 0.379 3.97 4 21.2 8.4
135 1 5 1 35.948 71.896 0.381 3.93 4 76.2 107.1
136 2 3 3 35.963 71.926 0.381 3.93 4 44.3 36.1
137 2 4 -3 36.133 72.265 0.383 3.89 4 69.7 88.7
138 5 1 -2 36.342 72.684 0.385 3.85 4 5.9 0.6
139 4 1 2 36.35 72.701 0.385 3.85 4 98.7 176.1
140 2 3 -4 36.474 72.949 0.386 3.82 4 2.4 0.1
141 0 3 4 36.478 72.956 0.386 3.82 4 30.1 16.2
142 4 0 -4 36.485 72.969 0.386 3.82 2 47.9 20.5
143 2 0 4 36.496 72.991 0.386 3.82 2 175.1 274.8
144 1 0 -5 36.736 73.472 0.388 3.77 2 23.7 5.0
145 3 4 1 36.798 73.596 0.389 3.76 4 46.0 37.3
146 5 1 0 36.885 73.77 0.39 3.74 4 87.8 135.3
147 2 5 0 37.124 74.248 0.392 3.7 4 84.2 123.0
148 2 5 -1 37.196 74.393 0.392 3.68 4 29.7 15.2
149 4 1 -4 37.222 74.443 0.393 3.68 4 155.5 417.5
150 2 1 4 37.232 74.465 0.393 3.68 4 10.4 1.9
151 1 4 3 37.384 74.768 0.394 3.65 4 37.3 23.9
152 1 5 -2 37.416 74.832 0.394 3.64 4 31.9 17.4
153 0 5 2 37.417 74.833 0.394 3.64 4 145.1 360.4
154 1 1 -5 37.471 74.942 0.395 3.63 4 91.8 143.8
155 3 2 3 37.68 75.361 0.397 3.6 4 7.0 0.8
156 4 3 1 37.866 75.731 0.398 3.57 4 37.9 24.0
157 2 1 -5 37.881 75.762 0.399 3.56 4 55.9 52.4
158 5 2 -1 37.915 75.83 0.399 3.56 4 1.2 0.0
159 5 0 -3 38.042 76.083 0.4 3.54 2 90.9 68.6
160 4 3 -3 38.439 76.878 0.404 3.47 4 17.6 5.1
161 5 2 -2 38.541 77.081 0.404 3.46 4 135.4 297.6
162 4 2 2 38.549 77.097 0.405 3.46 4 38.5 24.0
163 0 1 5 38.705 77.41 0.406 3.43 4 39.1 24.6
164 5 1 -3 38.768 77.536 0.406 3.42 4 40.8 26.8
165 2 5 1 38.842 77.683 0.407 3.41 4 1.8 0.1
166 3 3 -4 38.945 77.89 0.408 3.4 4 170.0 461.0
167 1 3 4 38.952 77.904 0.408 3.4 4 47.2 35.6
168 3 4 -3 39.02 78.039 0.409 3.39 4 47.5 35.9
169 2 5 -2 39.055 78.111 0.409 3.38 4 114.4 207.9
170 1 5 2 39.058 78.116 0.409 3.38 4 56.3 50.3
171 5 2 0 39.073 78.145 0.409 3.38 4 74.1 87.2
172 5 0 1 39.108 78.215 0.409 3.37 2 126.7 127.1
173 3 0 -5 39.198 78.397 0.41 3.36 2 70.9 39.6
174 4 2 -4 39.403 78.806 0.412 3.33 4 22.4 7.9
175 2 2 4 39.414 78.827 0.412 3.33 4 76.2 90.8
176 1 2 -5 39.648 79.296 0.414 3.3 4 4.1 0.3
177 4 4 -1 39.666 79.333 0.414 3.3 4 16.2 4.0
178 5 1 1 39.828 79.657 0.416 3.28 4 37.8 21.9
179 3 1 -5 39.919 79.837 0.417 3.26 4 56.3 48.6
180 2 2 -5 40.051 80.102 0.418 3.25 4 14.3 3.1
181 4 4 0 40.406 80.812 0.421 3.21 4 63.5 60.7
182 4 4 -2 40.688 81.376 0.423 3.17 4 64.6 62.2
183 3 4 2 40.694 81.388 0.423 3.17 4 28.7 12.3
184 1 4 -4 40.739 81.478 0.424 3.17 4 93.4 129.8
185 1 0 5 40.826 81.653 0.424 3.16 2 12.6 1.2
186 0 2 5 40.863 81.726 0.425 3.15 4 11.6 2.0
187 3 5 -1 40.866 81.732 0.425 3.15 4 99.4 146.3
188 5 2 -3 40.925 81.85 0.425 3.15 4 8.9 1.2
189 2 4 3 41.05 82.101 0.426 3.13 4 72.5 77.3
190 3 5 0 41.199 82.397 0.428 3.12 4 30.9 14.0
191 3 3 3 41.286 82.571 0.428 3.11 4 3.9 0.2
192 1 5 -3 41.435 82.87 0.43 3.09 4 15.0 3.3
193 5 3 -1 41.515 83.03 0.43 3.08 4 13.6 2.7
194 1 1 5 41.54 83.08 0.43 3.08 4 102.1 150.8
195 2 4 -4 41.542 83.084 0.43 3.08 4 62.7 57.0
196 0 4 4 41.545 83.091 0.431 3.08 4 83.1 99.9
197 0 6 0 41.807 83.614 0.433 3.06 2 159.5 182.5
198 0 5 3 41.838 83.676 0.433 3.05 4 10.6 1.6
199 5 2 1 41.973 83.945 0.434 3.04 4 50.6 36.6
200 3 2 -5 42.062 84.124 0.435 3.03 4 4.7 0.3
201 5 3 -2 42.127 84.253 0.435 3.03 4 29.1 12.0
202 4 3 2 42.134 84.269 0.435 3.03 4 17.5 4.4
203 3 5 -2 42.282 84.565 0.437 3.01 4 20.5 6.0
204 2 5 2 42.287 84.573 0.437 3.01 4 147.8 309.0
205 4 1 3 42.413 84.827 0.438 3.0 4 60.3 51.2
206 1 6 0 42.608 85.216 0.439 2.99 4 27.7 10.7
207 2 5 -3 42.636 85.273 0.44 2.98 4 22.4 7.1
208 5 3 0 42.648 85.297 0.44 2.98 4 147.9 306.2
209 0 6 1 42.679 85.357 0.44 2.98 4 17.7 4.4
210 4 4 1 42.888 85.776 0.442 2.96 4 80.2 89.5
211 5 1 -4 42.895 85.789 0.442 2.96 4 71.1 70.3
212 3 1 4 42.908 85.817 0.442 2.96 4 25.6 9.1
213 4 3 -4 42.973 85.946 0.442 2.96 4 17.6 4.3
214 2 3 4 42.984 85.967 0.443 2.96 4 2.5 0.1
215 1 6 -1 43.078 86.156 0.443 2.95 4 60.8 51.2
216 1 3 -5 43.214 86.429 0.444 2.94 4 5.4 0.4
217 3 5 1 43.274 86.548 0.445 2.93 4 59.2 48.3
218 4 4 -3 43.446 86.893 0.446 2.92 4 65.8 59.3
219 4 1 -5 43.53 87.061 0.447 2.92 4 36.2 17.9
220 2 3 -5 43.611 87.223 0.448 2.91 4 91.3 113.9
221 1 2 5 43.67 87.34 0.448 2.91 4 14.5 2.9
222 6 0 -2 43.738 87.477 0.449 2.9 2 165.1 185.6
223 1 5 3 43.839 87.677 0.45 2.89 4 49.4 33.2
224 1 6 1 43.877 87.755 0.45 2.89 4 58.2 46.0
225 3 4 -4 43.94 87.881 0.45 2.89 4 28.8 11.3
226 1 4 4 43.947 87.895 0.45 2.89 4 112.1 170.3
227 6 1 -1 44.237 88.474 0.453 2.87 4 36.3 17.8
228 0 3 5 44.414 88.827 0.454 2.86 4 87.7 103.2
229 6 1 -2 44.446 88.892 0.455 2.86 4 22.3 6.7
230 5 1 2 44.455 88.911 0.455 2.86 4 39.9 21.3
231 5 3 -3 44.475 88.95 0.455 2.86 4 4.0 0.2
232 4 2 3 44.539 89.077 0.455 2.85 4 64.3 55.3
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 1 0 -1 8.549 17.098 5.18176 638.4 12.5 12.6 5.6
2 1 1 0 9.326 18.652 4.75334 448.3 8.8 8.9 5.6
3 0 1 1 9.544 19.088 4.64574 1062.8 20.8 21.0 5.6
4 1 1 -1 10.695 21.39 4.15057 1870.7 36.6 36.9 5.6
5 1 0 1 10.942 21.884 4.05811 677.0 13.3 13.3 5.6
6 1 1 1 12.705 25.411 3.50226 693.8 13.6 13.6 5.6
7 0 2 0 12.839 25.677 3.4665 949.2 18.6 18.6 5.6
8 2 0 0 13.647 27.293 3.2648 3134.1 61.4 61.5 5.6
9 0 0 2 14.25 28.499 3.12937 281.4 5.5 5.5 5.6
10 1 2 0 14.571 29.142 3.06178 5105.2 100.0 100.0 5.6
11 0 2 1 14.715 29.43 3.03244 195.4 3.8 3.8 5.6
12 2 1 0 15.117 30.233 2.95369 808.6 15.8 15.8 5.6
13 2 1 -1 15.254 30.509 2.92764 147.6 2.9 2.9 5.6
14 0 1 2 15.668 31.335 2.85228 5074.5 99.4 99.2 5.6
15 2 0 -2 17.296 34.592 2.59088 1099.4 21.5 21.4 5.7
16 2 1 -2 18.505 37.01 2.42695 1398.6 27.4 27.2 5.7
17 2 2 0 18.911 37.822 2.37667 295.0 5.8 5.7 5.7
18 2 2 -1 19.024 38.049 2.36304 82.7 1.6 1.6 5.7
19 1 2 -2 19.365 38.73 2.32303 208.0 4.1 4.0 5.7
20 3 0 -1 20.223 40.447 2.22829 141.9 2.8 2.8 5.7
21 1 3 0 20.706 41.412 2.17858 51.9 1.0 1.0 5.7
22 0 3 1 20.812 41.624 2.16793 1217.1 23.8 23.6 5.7
23 1 0 -3 21.078 42.156 2.14181 1148.8 22.5 22.2 5.7
24 3 1 -1 21.291 42.581 2.12141 1219.7 23.9 23.6 5.7
25 2 2 1 21.483 42.966 2.10331 955.3 18.7 18.5 5.7
26 3 1 0 21.773 43.546 2.07661 138.1 2.7 2.7 5.7
27 1 3 1 22.555 45.11 2.0082 94.5 1.9 1.8 5.7
28 2 1 2 23.3 46.6 1.94737 1969.3 38.6 37.9 5.7
29 3 0 1 23.679 47.358 1.91798 356.7 7.0 6.9 5.7
30 2 3 -1 24.195 48.391 1.87942 749.5 14.7 14.4 5.7
31 1 0 3 24.437 48.873 1.862 212.4 4.2 4.1 5.7
32 1 3 -2 24.477 48.954 1.85911 1640.8 32.1 31.5 5.7
33 3 1 1 24.626 49.252 1.84855 83.4 1.6 1.6 5.7
34 3 2 0 24.701 49.401 1.84331 802.3 15.7 15.4 5.7
35 1 2 -3 25.008 50.017 1.82207 106.4 2.1 2.0 5.7
36 1 1 3 25.363 50.725 1.79827 56.3 1.1 1.1 5.8
37 0 2 3 25.526 51.053 1.7875 533.8 10.5 10.2 5.8
38 3 2 -2 26.091 52.181 1.75147 1039.8 20.4 19.9 5.8
39 2 3 1 26.266 52.532 1.7406 214.7 4.2 4.1 5.8
40 0 4 0 26.386 52.772 1.73325 225.2 4.4 4.3 5.8
41 3 0 -3 26.485 52.969 1.72725 256.9 5.0 4.9 5.8
42 2 2 -3 26.534 53.068 1.72426 1580.2 31.0 30.2 5.8
43 3 2 1 27.322 54.643 1.67823 66.2 1.3 1.3 5.8
44 1 4 0 27.374 54.749 1.67524 597.1 11.7 11.4 5.8
45 0 4 1 27.461 54.921 1.67038 65.5 1.3 1.2 5.8
46 4 0 0 28.156 56.311 1.6324 281.1 5.5 5.3 5.8
47 4 0 -2 28.489 56.978 1.61487 442.5 8.7 8.4 5.8
48 1 4 1 28.898 57.796 1.59395 69.9 1.4 1.3 5.8
49 4 1 0 28.998 57.995 1.58895 309.6 6.1 5.9 5.8
50 3 3 0 29.088 58.176 1.58445 228.4 4.5 4.3 5.8
51 3 1 2 29.332 58.664 1.57242 270.7 5.3 5.1 5.8
52 1 1 -4 29.384 58.768 1.56989 90.8 1.8 1.7 5.8
53 0 0 4 29.491 58.982 1.56469 316.3 6.2 6.0 5.8
54 2 4 0 30.209 60.418 1.53089 138.3 2.7 2.6 5.8
55 2 1 -4 30.306 60.611 1.52648 457.6 9.0 8.7 5.8
56 3 3 -2 30.339 60.677 1.52498 340.2 6.7 6.4 5.8
57 1 4 -2 30.531 61.063 1.51626 85.1 1.7 1.6 5.8
58 4 2 -2 31.75 63.5 1.46382 136.3 2.7 2.6 5.9
59 1 2 -4 31.806 63.612 1.4615 251.6 4.9 4.7 5.9
60 2 4 1 32.091 64.182 1.44989 133.4 2.6 2.5 5.9
61 2 2 3 32.149 64.298 1.44756 177.7 3.5 3.3 5.9
62 2 4 -2 32.323 64.646 1.44061 115.5 2.3 2.2 5.9
63 0 2 4 32.692 65.383 1.42614 83.4 1.6 1.6 5.9
64 3 1 -4 32.982 65.965 1.41496 120.7 2.4 2.3 5.9
65 4 2 1 34.145 68.29 1.37234 146.0 2.9 2.7 5.9
66 4 3 -1 34.514 69.028 1.35947 258.5 5.1 4.8 5.9
67 3 4 0 34.619 69.237 1.35586 226.7 4.4 4.2 5.9
68 3 0 3 34.711 69.422 1.3527 72.5 1.4 1.4 5.9
69 4 2 -3 34.742 69.485 1.35164 161.8 3.2 3.0 5.9
70 1 4 -3 34.869 69.738 1.34734 76.9 1.5 1.4 5.9
71 1 5 -1 35.104 70.208 1.33947 117.1 2.3 2.2 5.9
72 0 4 3 35.294 70.589 1.33318 667.6 13.1 12.4 5.9
73 3 3 2 35.591 71.183 1.32351 551.5 10.8 10.2 5.9
74 1 3 -4 35.638 71.276 1.32199 340.2 6.7 6.3 5.9
75 5 1 -1 35.703 71.406 1.31991 137.9 2.7 2.6 5.9
76 3 4 -2 35.762 71.524 1.31803 219.3 4.3 4.1 5.9
77 1 5 1 35.948 71.896 1.31212 143.2 2.8 2.7 5.9
78 2 4 -3 36.133 72.265 1.30632 88.7 1.7 1.6 5.9
79 4 1 2 36.35 72.701 1.29957 176.1 3.4 3.3 6.0
80 2 0 4 36.496 72.991 1.29511 311.6 6.1 5.8 6.0
81 5 1 0 36.885 73.77 1.28335 135.3 2.7 2.5 6.0
82 2 5 0 37.124 74.248 1.27626 123.0 2.4 2.3 6.0
83 4 1 -4 37.222 74.443 1.2734 434.6 8.5 8.0 6.0
84 0 5 2 37.417 74.833 1.26773 377.7 7.4 7.0 6.0
85 1 1 -5 37.471 74.942 1.26616 143.8 2.8 2.7 6.0
86 2 1 -5 37.881 75.762 1.25448 76.4 1.5 1.4 6.0
87 5 0 -3 38.042 76.083 1.24998 68.6 1.3 1.3 6.0
88 5 2 -2 38.541 77.081 1.23627 321.6 6.3 5.9 6.0
89 3 3 -4 38.945 77.89 1.22544 496.6 9.7 9.1 6.0
90 2 5 -2 39.055 78.111 1.22253 345.4 6.8 6.3 6.0
91 5 0 1 39.108 78.215 1.22116 127.1 2.5 2.3 6.0
92 2 2 4 39.414 78.827 1.2132 98.7 1.9 1.8 6.0
93 4 4 0 40.406 80.812 1.18834 60.7 1.2 1.1 6.1
94 4 4 -2 40.688 81.376 1.18152 74.5 1.5 1.4 6.1
95 1 4 -4 40.739 81.478 1.1803 129.8 2.5 2.4 6.1
96 3 5 -1 40.866 81.732 1.17728 148.3 2.9 2.7 6.1
97 2 4 3 41.05 82.101 1.17292 77.3 1.5 1.4 6.1
98 2 4 -4 41.542 83.084 1.16151 310.4 6.1 5.6 6.1
99 0 6 0 41.807 83.614 1.1555 182.5 3.6 3.3 6.1
100 2 5 2 42.287 84.573 1.14482 315.0 6.2 5.7 6.1
101 4 1 3 42.413 84.827 1.14205 51.2 1.0 0.9 6.1
102 5 3 0 42.648 85.297 1.13695 310.6 6.1 5.6 6.1
103 4 4 1 42.888 85.776 1.13182 168.9 3.3 3.0 6.1
104 1 6 -1 43.078 86.156 1.1278 51.2 1.0 0.9 6.1
105 4 4 -3 43.446 86.893 1.12012 59.3 1.2 1.1 6.1
106 2 3 -5 43.611 87.223 1.11673 113.9 2.2 2.0 6.2
107 6 0 -2 43.738 87.477 1.11414 185.6 3.6 3.3 6.2
108 1 4 4 43.947 87.895 1.10992 181.6 3.6 3.2 6.2
109 0 3 5 44.414 88.827 1.10066 103.2 2.0 1.8 6.2
110 4 2 3 44.539 89.077 1.09822 55.3 1.1 1.0 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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