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 ***
***********************
UMBITE
2, f-kostylevite
K(2)Zr[Si(3)O(9)].H(2)O
Orthorhombic P 2(1)2(1)2(1) Z = 4
R =0.061 NR =876
13 .4 .1994
Ref.Str.:
Iliushin G.D., Pudovkina Z.V., Khomyakov A.P., Iliukhin V.V.,
Pyatenko Yu.A. (1981)
* Dokl. Akad. Nauk SSSR, 257, 3, 608-610
Reserv:
In original - newmineral[3]. D.T.N.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 10.208 alpha = 90.0
b = 13.241 beta = 90.0
c = 7.174 gamma = 90.0
Unit cell volume (cub. angs.) = 969.67
Molar volume ( cub.cm/mol.) = 146.02
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0502 0.7098 0.2601 1.35 Zr = 1.00
2 0.0325 0.4514 0.2304 1.04 Si = 1.00
3 0.1755 0.3276 0.5051 1.0 Si = 1.00
4 0.138 0.3331 0.9181 0.94 Si = 1.00
5 0.0727 0.578 0.7122 1.92 K = 1.00
6 0.2093 0.8653 0.6499 3.28 K = 1.00
7 0.08 0.866 0.244 1.87 O = 1.00
8 0.113 0.231 0.409 1.64 O = 1.00
9 0.057 0.241 0.999 1.55 O = 1.00
10 0.987 0.564 0.269 1.41 O = 1.00
11 0.156 0.426 0.372 1.78 O = 1.00
12 0.207 0.687 0.434 1.35 O = 1.00
13 0.099 0.355 0.701 1.21 O = 1.00
14 0.094 0.438 0.018 1.75 O = 1.00
15 0.167 0.688 0.043 0.95 O = 1.00
16 0.182 0.065 0.628 3.95 H(2)O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0502 0.7098 0.2601
2 2 0.0325 0.4514 0.2304
3 3 0.1755 0.3276 0.5051
4 4 0.138 0.3331 0.9181
5 5 0.0727 0.578 0.7122
6 6 0.2093 0.8653 0.6499
7 7 0.08 0.866 0.244
8 8 0.113 0.231 0.409
9 9 0.057 0.241 0.999
10 10 0.987 0.564 0.269
11 11 0.156 0.426 0.372
12 12 0.207 0.687 0.434
13 13 0.099 0.355 0.701
14 14 0.094 0.438 0.018
15 15 0.167 0.688 0.043
16 16 0.182 0.065 0.628
17 1 0.4498 0.2902 0.7601
18 2 0.4675 0.5486 0.7304
19 3 0.3245 0.6724 0.0051
20 4 0.362 0.6669 0.4181
21 5 0.4273 0.422 0.2122
22 6 0.2907 0.1347 0.1499
23 7 0.42 0.134 0.744
24 8 0.387 0.769 0.909
25 9 0.443 0.759 0.499
26 10 0.513 0.436 0.769
27 11 0.344 0.574 0.872
28 12 0.293 0.313 0.934
29 13 0.401 0.645 0.201
30 14 0.406 0.562 0.518
31 15 0.333 0.312 0.543
32 16 0.318 0.935 0.128
33 1 0.9498 0.2098 0.2399
34 2 0.9675 0.9514 0.2696
35 3 0.8245 0.8276 0.9949
36 4 0.862 0.8331 0.5819
37 5 0.9273 0.078 0.7878
38 6 0.7907 0.3653 0.8501
39 7 0.92 0.366 0.256
40 8 0.887 0.731 0.091
41 9 0.943 0.741 0.501
42 10 0.013 0.064 0.231
43 11 0.844 0.926 0.128
44 12 0.793 0.187 0.066
45 13 0.901 0.855 0.799
46 14 0.906 0.938 0.482
47 15 0.833 0.188 0.457
48 16 0.818 0.565 0.872
49 1 0.5502 0.7902 0.7399
50 2 0.5325 0.0486 0.7696
51 3 0.6755 0.1724 0.4949
52 4 0.638 0.1669 0.0819
53 5 0.5727 0.922 0.2878
54 6 0.7093 0.6347 0.3501
55 7 0.58 0.634 0.756
56 8 0.613 0.269 0.591
57 9 0.557 0.259 0.001
58 10 0.487 0.936 0.731
59 11 0.656 0.074 0.628
60 12 0.707 0.813 0.566
61 13 0.599 0.145 0.299
62 14 0.594 0.062 0.982
63 15 0.667 0.812 0.957
64 16 0.682 0.435 0.372
X-ray density (g/cm cub.) = 2.85
MU (1/cm) = 213.618 Mass attenuation coefficient (cm**2/g) = 75.047
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Zr 2.784 6
2.0937 7
2.0365 10
2.0517 12
1.9826 15
2.0799 8
2.0868 9
2 Si 2.268 4
1.586 10
1.6536 11
1.6575 14
1.6221 7
3 Si 2.268 4
1.5869 8
1.6276 11
1.6482 13
1.6436 15
4 Si 2.268 4
1.5836 9
1.6335 13
1.6262 14
1.6085 12
5 K 3.396 9
3.3029 10
3.2757 11
2.8188 12
2.966 13
2.8804 14
2.9462 15
2.9978 11
2.9507 9
2.8467 16
6 K 3.396 8
3.1971 7
2.8237 12
2.6635 16
2.8933 8
2.9739 9
3.3525 9
3.3267 13
3.0415 10
7 O 3.432 8
3.0259 12
2.9022 15
2.7258 16
2.8778 8
2.8451 9
2.7111 10
2.6697 11
2.6418 14
8 O 3.432 8
2.9993 9
2.6325 11
2.6654 13
2.7921 16
2.6679 15
2.8778 7
2.75 10
2.9347 15
9 O 3.432 7
2.9993 8
2.6519 13
2.6392 14
2.6325 12
2.8451 7
2.9094 10
2.8293 12
10 O 3.432 8
2.6194 11
3.0161 12
2.6868 14
2.9497 15
2.7111 7
2.75 8
2.9094 9
3.3298 16
11 O 3.432 7
2.6325 8
2.6194 10
2.6064 13
2.6221 14
3.2943 14
2.6548 15
2.6697 7
12 O 3.432 7
3.0259 7
3.0161 10
2.8346 15
2.6325 9
2.6505 13
2.6887 14
2.8293 9
13 O 3.432 6
2.6654 8
2.6519 9
2.6064 11
2.5263 14
2.6505 12
2.7046 15
14 O 3.432 8
2.6392 9
2.6868 10
2.6221 11
2.5263 13
3.3978 15
3.2943 11
2.6887 12
2.6418 7
15 O 3.432 8
2.9022 7
2.9497 10
2.8346 12
3.3978 14
2.6679 8
2.6548 11
2.7046 13
2.9347 8
16 H(2)O 3.6 4
2.7921 8
2.7258 7
3.3298 10
3.4442 14
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 5.467 10.935 0.062 217.33 4 77.4 554.0
2 0 2 0 6.681 13.363 0.076 144.78 2 143.9 638.0
3 0 1 1 7.014 14.029 0.079 131.15 4 33.4 62.3
4 1 0 1 7.541 15.082 0.085 113.17 4 153.9 1140.2
5 1 2 0 7.971 15.942 0.09 101.05 4 0.9 0.0
6 1 1 1 8.253 16.507 0.093 94.11 8 35.9 103.4
7 2 0 0 8.68 17.36 0.098 84.88 2 127.9 295.5
8 0 2 1 9.109 18.219 0.103 76.86 4 64.2 134.9
9 2 1 0 9.308 18.616 0.105 73.52 4 2.2 0.2
10 1 2 1 10.101 20.202 0.114 62.11 8 94.6 472.5
11 2 0 1 10.674 21.347 0.12 55.4 4 37.9 33.8
12 1 3 0 10.961 21.921 0.123 52.42 4 88.4 174.2
13 2 2 0 10.985 21.971 0.124 52.18 4 8.1 1.4
14 2 1 1 11.194 22.388 0.126 50.17 8 27.2 31.5
15 0 3 1 11.824 23.648 0.133 44.75 4 22.3 9.5
16 0 0 2 12.4 24.801 0.139 40.5 2 152.5 200.4
17 1 3 1 12.613 25.225 0.142 39.08 8 77.6 200.2
18 2 2 1 12.634 25.268 0.142 38.94 8 29.8 29.4
19 0 1 2 12.855 25.71 0.144 37.54 4 61.1 59.7
20 1 0 2 13.157 26.313 0.148 35.75 4 29.5 13.2
21 2 3 0 13.34 26.679 0.15 34.72 4 38.2 21.5
22 0 4 0 13.456 26.912 0.151 34.09 2 41.6 12.6
23 3 1 0 13.517 27.034 0.152 33.76 4 152.0 332.0
24 1 1 2 13.588 27.175 0.152 33.39 8 41.6 49.1
25 0 2 2 14.137 28.273 0.159 30.7 4 38.3 19.2
26 1 4 0 14.16 28.319 0.159 30.59 4 65.4 55.7
27 3 0 1 14.51 29.02 0.163 29.04 4 156.1 301.2
28 2 3 1 14.743 29.486 0.165 28.07 8 4.9 0.6
29 3 2 0 14.745 29.491 0.165 28.06 4 126.0 189.4
30 1 2 2 14.811 29.621 0.166 27.79 8 85.1 171.1
31 0 4 1 14.849 29.698 0.166 27.64 4 265.5 828.9
32 3 1 1 14.905 29.81 0.167 27.42 8 112.0 292.5
33 2 0 2 15.217 30.433 0.17 26.23 4 217.1 525.7
34 1 4 1 15.495 30.99 0.173 25.23 8 118.2 300.1
35 2 1 2 15.595 31.19 0.175 24.88 8 162.0 555.6
36 3 2 1 16.036 32.072 0.179 23.43 8 59.6 70.8
37 0 3 2 16.064 32.129 0.18 23.34 4 68.0 45.9
38 2 4 0 16.102 32.204 0.18 23.22 4 113.4 126.9
39 3 3 0 16.609 33.218 0.186 21.71 4 61.0 34.4
40 1 3 2 16.668 33.335 0.186 21.55 8 64.2 75.6
41 2 2 2 16.684 33.369 0.186 21.5 8 49.7 45.2
42 2 4 1 17.302 34.604 0.193 19.86 8 89.2 134.5
43 1 5 0 17.488 34.975 0.195 19.41 4 99.7 82.1
44 4 0 0 17.568 35.136 0.196 19.21 2 30.2 3.7
45 3 3 1 17.779 35.557 0.198 18.72 8 104.2 173.1
46 4 1 0 17.902 35.804 0.2 18.44 4 82.6 53.6
47 0 5 1 18.062 36.125 0.201 18.08 4 1.3 0.0
48 3 0 2 18.181 36.363 0.203 17.82 4 30.4 7.0
49 2 3 2 18.373 36.745 0.205 17.42 8 35.5 18.7
50 0 4 2 18.46 36.92 0.206 17.24 4 1.0 0.0
51 3 1 2 18.506 37.012 0.206 17.14 8 93.5 127.6
52 1 5 1 18.609 37.218 0.207 16.93 8 22.5 7.3
53 4 0 1 18.685 37.37 0.208 16.78 4 83.4 49.7
54 4 2 0 18.874 37.747 0.21 16.41 4 18.7 2.4
55 3 4 0 18.944 37.888 0.211 16.28 4 84.6 49.6
56 1 4 2 18.996 37.993 0.211 16.18 8 68.7 64.9
57 4 1 1 19.002 38.004 0.211 16.17 8 68.5 64.6
58 0 1 3 19.106 38.213 0.212 15.98 4 58.8 23.5
59 2 5 0 19.129 38.257 0.213 15.93 4 16.9 1.9
60 1 0 3 19.319 38.639 0.215 15.59 4 126.5 106.2
61 3 2 2 19.452 38.903 0.216 15.35 8 47.9 30.0
62 1 1 3 19.628 39.256 0.218 15.05 8 37.1 17.6
63 4 2 1 19.928 39.856 0.221 14.55 8 32.6 13.2
64 3 4 1 19.995 39.99 0.222 14.44 8 10.9 1.4
65 0 2 3 20.028 40.056 0.222 14.39 4 44.1 11.9
66 2 5 1 20.172 40.343 0.224 14.16 8 93.4 105.0
67 4 3 0 20.405 40.81 0.226 13.81 4 23.5 3.2
68 0 6 0 20.429 40.858 0.227 13.77 2 19.4 1.1
69 1 2 3 20.53 41.06 0.228 13.62 8 65.6 49.9
70 2 4 2 20.534 41.068 0.228 13.61 8 43.7 22.1
71 2 0 3 20.837 41.674 0.231 13.17 4 99.1 55.1
72 1 6 0 20.923 41.845 0.232 13.05 4 141.4 111.1
73 3 3 2 20.948 41.895 0.232 13.02 8 70.5 55.0
74 2 1 3 21.127 42.254 0.234 12.77 8 44.5 21.6
75 0 5 2 21.195 42.391 0.235 12.68 4 1.3 0.0
76 4 3 1 21.396 42.792 0.237 12.42 8 21.7 5.0
77 0 6 1 21.419 42.838 0.237 12.39 4 52.0 14.3
78 0 3 3 21.491 42.982 0.238 12.29 4 21.1 2.3
79 3 5 0 21.628 43.256 0.239 12.12 4 12.4 0.8
80 1 5 2 21.675 43.35 0.24 12.06 8 20.6 4.3
81 4 0 2 21.742 43.484 0.24 11.98 4 95.8 46.8
82 1 6 1 21.895 43.789 0.242 11.79 8 39.1 15.4
83 1 3 3 21.965 43.93 0.243 11.7 8 26.6 7.0
84 2 2 3 21.979 43.957 0.243 11.69 8 40.4 16.2
85 4 1 2 22.022 44.045 0.243 11.64 8 118.0 137.8
86 2 6 0 22.351 44.701 0.247 11.25 4 107.8 55.7
87 4 4 0 22.403 44.806 0.247 11.2 4 38.6 7.1
88 5 1 0 22.442 44.884 0.248 11.15 4 27.1 3.5
89 3 5 1 22.575 45.151 0.249 11.0 8 95.9 86.1
90 4 2 2 22.847 45.694 0.252 10.71 8 13.9 1.8
91 3 4 2 22.907 45.814 0.253 10.65 8 40.4 14.8
92 2 5 2 23.066 46.131 0.254 10.48 8 39.8 14.1
93 5 0 1 23.096 46.192 0.255 10.45 4 30.3 4.1
94 3 0 3 23.185 46.37 0.256 10.36 4 95.2 40.0
95 5 2 0 23.255 46.51 0.256 10.29 4 7.4 0.2
96 2 6 1 23.275 46.549 0.256 10.27 8 93.0 75.5
97 4 4 1 23.325 46.651 0.257 10.22 8 15.2 2.0
98 2 3 3 23.342 46.684 0.257 10.2 8 46.9 19.1
99 5 1 1 23.363 46.727 0.257 10.18 8 65.8 37.5
100 0 4 3 23.414 46.828 0.258 10.13 4 33.8 4.9
101 3 1 3 23.452 46.904 0.258 10.09 8 89.7 69.1
102 1 4 3 23.858 47.716 0.263 9.71 8 47.7 18.8
103 5 2 1 24.152 48.305 0.266 9.44 8 38.6 12.0
104 4 3 2 24.172 48.345 0.266 9.42 8 72.1 41.7
105 0 6 2 24.193 48.386 0.266 9.41 4 81.3 26.5
106 3 2 3 24.238 48.477 0.266 9.37 8 46.7 17.4
107 1 7 0 24.466 48.932 0.269 9.17 4 74.3 21.5
108 5 3 0 24.563 49.127 0.27 9.09 4 29.3 3.3
109 3 6 0 24.584 49.168 0.27 9.07 4 1.3 0.0
110 1 6 2 24.626 49.253 0.27 9.03 8 103.9 83.0
111 4 5 0 24.783 49.565 0.272 8.91 4 21.2 1.7
112 0 7 1 24.906 49.812 0.273 8.81 4 13.9 0.7
113 2 4 3 25.155 50.31 0.276 8.61 8 131.1 125.9
114 3 5 2 25.25 50.501 0.277 8.53 8 75.0 40.9
115 1 7 1 25.331 50.661 0.278 8.47 8 41.6 12.4
116 5 3 1 25.426 50.852 0.279 8.4 8 127.1 115.5
117 0 0 4 25.435 50.87 0.279 8.39 2 167.7 50.2
118 3 6 1 25.446 50.892 0.279 8.39 8 12.7 1.2
119 3 3 3 25.509 51.018 0.28 8.34 8 115.6 94.9
120 4 5 1 25.64 51.279 0.281 8.24 8 144.8 147.1
121 0 1 4 25.684 51.368 0.281 8.21 4 27.8 2.7
122 0 5 3 25.722 51.444 0.282 8.18 4 50.3 8.8
123 5 0 2 25.73 51.459 0.282 8.18 4 49.3 8.5
124 2 7 0 25.74 51.479 0.282 8.17 4 41.3 5.9
125 1 0 4 25.853 51.706 0.283 8.09 4 65.5 14.8
126 2 6 2 25.895 51.789 0.283 8.06 8 17.6 2.1
127 4 4 2 25.941 51.883 0.284 8.03 8 28.0 5.4
128 5 1 2 25.977 51.953 0.284 8.0 8 80.1 43.7
129 1 1 4 26.099 52.198 0.286 7.92 8 68.8 31.9
130 1 5 3 26.137 52.274 0.286 7.89 8 24.1 3.9
131 4 0 3 26.195 52.39 0.287 7.85 4 43.3 6.3
132 5 4 0 26.313 52.627 0.288 7.77 4 9.7 0.3
133 0 2 4 26.421 52.842 0.289 7.7 4 64.6 13.7
134 4 1 3 26.439 52.878 0.289 7.69 8 29.5 5.7
135 2 7 1 26.574 53.149 0.29 7.6 8 66.9 28.9
136 5 2 2 26.708 53.416 0.292 7.51 8 21.1 2.9
137 1 2 4 26.828 53.656 0.293 7.43 8 39.4 9.8
138 6 0 0 26.92 53.841 0.294 7.38 2 14.4 0.3
139 2 0 4 27.08 54.159 0.295 7.28 4 170.0 89.5
140 5 4 1 27.136 54.271 0.296 7.24 8 11.5 0.8
141 6 1 0 27.16 54.319 0.296 7.23 4 149.1 68.4
142 4 2 3 27.162 54.324 0.296 7.23 8 50.5 15.7
143 3 4 3 27.215 54.43 0.297 7.2 8 62.4 23.8
144 2 1 4 27.318 54.636 0.298 7.13 8 59.1 21.2
145 2 5 3 27.355 54.709 0.298 7.11 8 120.6 88.0
146 0 7 2 27.411 54.822 0.299 7.08 4 27.8 2.3
147 4 6 0 27.481 54.961 0.3 7.04 4 24.3 1.8
148 0 3 4 27.619 55.238 0.301 6.96 4 7.4 0.2
149 6 0 1 27.73 55.46 0.302 6.9 4 52.5 8.1
150 0 8 0 27.736 55.471 0.302 6.89 2 140.2 28.8
151 3 7 0 27.769 55.538 0.302 6.87 4 87.9 22.6
152 1 7 2 27.808 55.616 0.303 6.85 8 58.2 19.8
153 6 2 0 27.87 55.739 0.303 6.82 4 12.6 0.5
154 5 3 2 27.897 55.795 0.304 6.8 8 87.4 44.2
155 3 6 2 27.916 55.832 0.304 6.79 8 42.1 10.3
156 6 1 1 27.965 55.93 0.304 6.76 8 75.6 32.9
157 1 3 4 28.014 56.028 0.305 6.74 8 65.1 24.3
158 2 2 4 28.025 56.051 0.305 6.73 8 34.3 6.7
159 4 5 2 28.098 56.196 0.306 6.69 8 69.4 27.4
160 1 8 0 28.13 56.259 0.306 6.68 4 181.3 93.3
161 4 6 1 28.28 56.559 0.308 6.6 8 8.4 0.4
162 4 3 3 28.338 56.677 0.308 6.56 8 60.5 20.4
163 0 6 3 28.357 56.714 0.308 6.55 4 67.4 12.7
164 5 5 0 28.45 56.901 0.309 6.51 4 46.3 5.9
165 0 8 1 28.53 57.06 0.31 6.46 4 46.7 6.0
166 3 7 1 28.563 57.126 0.31 6.45 8 4.7 0.1
167 6 2 1 28.661 57.323 0.311 6.4 8 17.8 1.7
168 1 6 3 28.745 57.491 0.312 6.36 8 58.0 18.2
169 1 8 1 28.917 57.834 0.314 6.27 8 52.4 14.6
170 2 7 2 28.978 57.956 0.314 6.24 8 11.8 0.7
171 6 3 0 29.027 58.054 0.315 6.22 4 55.5 8.1
172 3 0 4 29.045 58.089 0.315 6.21 4 29.0 2.2
173 2 3 4 29.179 58.357 0.316 6.14 8 26.1 3.6
174 5 5 1 29.232 58.464 0.317 6.12 8 38.1 7.6
175 0 4 4 29.24 58.48 0.317 6.12 4 61.8 9.9
176 3 1 4 29.273 58.545 0.317 6.1 8 30.1 4.7
177 2 8 0 29.291 58.582 0.318 6.09 4 47.3 5.8
178 3 5 3 29.308 58.615 0.318 6.08 8 9.9 0.5
179 5 4 2 29.509 59.017 0.32 5.99 8 50.4 12.9
180 1 4 4 29.621 59.243 0.321 5.94 8 76.8 29.8
181 5 0 3 29.742 59.483 0.322 5.89 4 43.9 4.8
182 6 3 1 29.799 59.598 0.323 5.86 8 92.4 42.5
183 2 6 3 29.892 59.783 0.323 5.82 8 77.4 29.6
184 4 4 3 29.934 59.869 0.324 5.8 8 63.1 19.7
185 3 2 4 29.95 59.899 0.324 5.8 8 30.1 4.5
186 5 1 3 29.966 59.933 0.324 5.79 8 118.4 69.0
187 2 8 1 30.059 60.118 0.325 5.75 8 84.1 34.6
188 6 0 2 30.073 60.145 0.325 5.74 4 83.8 17.2
189 6 1 2 30.296 60.591 0.327 5.65 8 90.9 39.7
190 4 7 0 30.456 60.913 0.329 5.58 4 17.8 0.7
191 4 6 2 30.595 61.19 0.33 5.53 8 41.7 8.2
192 6 4 0 30.6 61.201 0.33 5.52 4 9.8 0.2
193 5 2 3 30.634 61.268 0.331 5.51 8 38.4 6.9
194 2 4 4 30.747 61.495 0.332 5.47 8 65.1 19.7
195 0 8 2 30.834 61.667 0.333 5.43 4 23.1 1.2
196 3 7 2 30.865 61.73 0.333 5.42 8 101.2 47.2
197 5 6 0 30.93 61.859 0.334 5.39 4 9.7 0.2
198 6 2 2 30.959 61.918 0.334 5.38 8 73.6 24.8
199 3 3 4 31.058 62.116 0.335 5.35 8 11.8 0.6
200 3 8 0 31.167 62.333 0.336 5.3 4 15.9 0.6
201 1 8 2 31.203 62.406 0.336 5.29 8 102.5 47.3
202 4 7 1 31.207 62.414 0.336 5.29 8 77.2 26.8
203 0 5 4 31.246 62.492 0.337 5.27 4 23.4 1.2
204 0 7 3 31.28 62.559 0.337 5.26 4 35.5 2.8
205 6 4 1 31.349 62.698 0.338 5.24 8 57.8 14.9
206 5 5 2 31.504 63.008 0.339 5.18 8 111.1 54.4
207 1 5 4 31.612 63.225 0.34 5.14 8 29.2 3.7
208 1 7 3 31.646 63.292 0.341 5.13 8 62.1 16.8
209 4 0 4 31.664 63.328 0.341 5.12 4 39.9 3.5
210 5 6 1 31.674 63.347 0.341 5.12 8 29.3 3.7
211 5 3 3 31.728 63.457 0.341 5.1 8 107.6 50.2
212 3 6 3 31.746 63.491 0.342 5.09 8 35.5 5.5
213 4 1 4 31.881 63.761 0.343 5.05 8 97.3 40.6
214 3 8 1 31.907 63.815 0.343 5.04 8 31.9 4.4
215 4 5 3 31.914 63.828 0.343 5.04 8 107.6 49.6
216 1 9 0 31.936 63.872 0.343 5.03 4 66.6 9.5
217 6 3 2 32.047 64.094 0.344 4.99 8 72.5 22.3
218 7 1 0 32.1 64.201 0.345 4.97 4 33.2 2.3
219 2 8 2 32.297 64.593 0.347 4.91 8 102.5 43.9
220 0 9 1 32.307 64.615 0.347 4.9 4 23.5 1.1
221 4 2 4 32.526 65.051 0.349 4.83 8 20.1 1.7
222 6 5 0 32.557 65.113 0.349 4.82 4 48.6 4.8
223 3 4 4 32.573 65.146 0.349 4.82 8 58.7 14.1
224 7 0 1 32.616 65.233 0.35 4.8 4 2.8 0.0
225 1 9 1 32.667 65.335 0.35 4.79 8 25.2 2.6
226 0 1 5 32.683 65.367 0.351 4.78 4 14.7 0.4
227 2 5 4 32.699 65.397 0.351 4.78 8 45.9 8.6
228 2 7 3 32.731 65.463 0.351 4.77 8 27.9 3.2
229 7 2 0 32.743 65.486 0.351 4.76 4 40.6 3.3
230 1 0 5 32.829 65.658 0.352 4.74 4 115.6 26.9
231 7 1 1 32.83 65.659 0.352 4.74 8 49.6 9.9
232 2 9 0 33.017 66.033 0.354 4.68 4 52.6 5.5
233 1 1 5 33.041 66.083 0.354 4.67 8 80.8 26.0
234 5 4 3 33.227 66.454 0.356 4.62 8 35.7 5.0
235 6 5 1 33.281 66.561 0.356 4.6 8 92.8 33.7
236 0 2 5 33.32 66.64 0.357 4.59 4 25.9 1.3
237 4 7 2 33.401 66.802 0.357 4.57 8 34.8 4.7
238 7 2 1 33.465 66.93 0.358 4.55 8 87.7 29.8
239 6 4 2 33.538 67.076 0.359 4.53 8 53.1 10.9
240 4 3 4 33.586 67.172 0.359 4.51 8 62.7 15.1
241 0 6 4 33.603 67.206 0.359 4.51 4 16.2 0.5
242 1 2 5 33.675 67.349 0.36 4.49 8 55.6 11.8
243 4 8 0 33.69 67.38 0.36 4.48 4 3.3 0.0
244 5 7 0 33.72 67.44 0.36 4.48 4 133.9 34.1
245 2 9 1 33.736 67.471 0.36 4.47 8 44.2 7.4
246 6 0 3 33.755 67.51 0.361 4.47 4 22.3 0.9
247 7 3 0 33.8 67.6 0.361 4.45 4 62.1 7.3
248 5 6 2 33.851 67.703 0.362 4.44 8 27.5 2.9
249 2 0 5 33.894 67.789 0.362 4.43 4 43.5 3.6
250 1 6 4 33.956 67.912 0.363 4.41 8 63.3 15.0
251 6 1 3 33.965 67.929 0.363 4.41 8 31.5 3.7
252 3 8 2 34.077 68.155 0.364 4.38 8 89.2 29.6
253 2 1 5 34.104 68.207 0.364 4.37 8 64.6 15.5
254 4 6 3 34.246 68.493 0.365 4.33 8 22.3 1.8
255 0 3 5 34.368 68.737 0.366 4.3 4 27.9 1.4
256 4 8 1 34.402 68.804 0.367 4.29 8 50.7 9.4
257 5 7 1 34.432 68.863 0.367 4.29 8 22.2 1.8
258 0 9 2 34.464 68.929 0.367 4.28 4 17.6 0.6
259 3 5 4 34.469 68.938 0.367 4.28 8 58.8 12.6
260 0 8 3 34.471 68.942 0.367 4.28 4 96.1 16.8
261 3 7 3 34.501 69.002 0.368 4.27 8 16.6 1.0
262 7 3 1 34.511 69.022 0.368 4.27 8 91.2 30.2
263 6 2 3 34.59 69.179 0.368 4.25 8 21.2 1.6
264 1 3 5 34.718 69.435 0.37 4.21 8 64.8 15.1
265 2 2 5 34.727 69.455 0.37 4.21 8 28.2 2.8
266 7 0 2 34.764 69.527 0.37 4.2 4 16.4 0.5
267 3 9 0 34.779 69.557 0.37 4.2 4 4.8 0.0
268 1 9 2 34.813 69.626 0.371 4.19 8 55.9 11.1
269 1 8 3 34.82 69.64 0.371 4.19 8 44.1 6.9
270 5 0 4 34.867 69.733 0.371 4.18 4 4.9 0.0
271 6 6 0 34.867 69.734 0.371 4.18 4 57.2 5.8
272 7 1 2 34.97 69.941 0.372 4.15 8 29.1 3.0
273 2 6 4 35.004 70.009 0.372 4.14 8 50.3 8.9
274 4 4 4 35.044 70.087 0.373 4.13 8 48.7 8.3
275 5 1 4 35.073 70.146 0.373 4.13 8 55.2 10.7
276 5 5 3 35.105 70.21 0.373 4.12 8 52.0 9.5
277 7 4 0 35.253 70.507 0.375 4.09 4 36.0 2.3
278 6 5 2 35.408 70.816 0.376 4.05 8 22.5 1.8
279 3 9 1 35.481 70.961 0.377 4.03 8 21.8 1.6
280 6 6 1 35.568 71.137 0.378 4.01 8 57.3 11.2
281 0 10 0 35.573 71.146 0.378 4.01 2 19.6 0.3
282 7 2 2 35.587 71.174 0.378 4.01 8 8.1 0.2
283 6 3 3 35.62 71.24 0.378 4.0 8 20.8 1.5
284 3 0 5 35.636 71.272 0.378 4.0 4 49.7 4.2
285 5 2 4 35.689 71.379 0.379 3.99 8 41.8 5.9
286 2 3 5 35.756 71.512 0.379 3.97 8 5.4 0.1
287 0 4 5 35.811 71.622 0.38 3.96 4 107.8 19.6
288 3 1 5 35.84 71.681 0.38 3.95 8 43.8 6.5
289 2 9 2 35.85 71.701 0.38 3.95 8 43.7 6.4
290 2 8 3 35.857 71.714 0.38 3.95 8 51.4 8.9
291 1 10 0 35.917 71.834 0.381 3.94 4 33.8 1.9
292 7 4 1 35.951 71.902 0.381 3.93 8 52.0 9.0
293 1 4 5 36.154 72.309 0.383 3.89 8 75.6 18.9
294 0 10 1 36.268 72.536 0.384 3.86 4 73.3 8.8
295 0 7 4 36.288 72.576 0.384 3.86 4 11.5 0.2
296 3 2 5 36.451 72.902 0.386 3.83 8 30.5 3.0
297 4 8 2 36.5 72.999 0.386 3.82 8 51.5 8.6
298 5 7 2 36.528 73.057 0.386 3.81 8 102.6 34.1
299 7 3 2 36.606 73.211 0.387 3.8 8 30.5 3.0
300 1 10 1 36.609 73.219 0.387 3.79 8 34.9 3.9
301 1 7 4 36.629 73.259 0.387 3.79 8 38.2 4.7
302 5 3 4 36.706 73.413 0.388 3.78 8 36.7 4.3
303 3 6 4 36.723 73.445 0.388 3.77 8 54.8 9.6
304 5 8 0 36.807 73.613 0.389 3.76 4 10.4 0.2
305 4 5 4 36.88 73.76 0.39 3.74 8 46.1 6.8
306 4 7 3 36.911 73.822 0.39 3.74 8 82.5 21.6
307 2 10 0 36.941 73.882 0.39 3.73 4 17.7 0.5
308 6 4 3 37.042 74.084 0.391 3.71 8 65.7 13.6
309 7 5 0 37.085 74.17 0.391 3.7 4 97.3 14.9
310 8 0 0 37.133 74.266 0.392 3.7 2 114.5 10.3
311 2 4 5 37.176 74.352 0.392 3.69 8 72.9 16.7
312 4 9 0 37.181 74.362 0.392 3.69 4 103.9 16.9
313 8 1 0 37.334 74.669 0.394 3.66 4 11.1 0.2
314 5 6 3 37.343 74.685 0.394 3.66 8 52.3 8.5
315 3 3 5 37.46 74.92 0.395 3.64 8 71.5 15.8
316 5 8 1 37.493 74.985 0.395 3.63 8 56.0 9.7
317 6 7 0 37.513 75.026 0.395 3.63 4 4.4 0.0
318 3 9 2 37.553 75.105 0.396 3.62 8 41.9 5.4
319 3 8 3 37.559 75.119 0.396 3.62 8 49.9 7.7
320 2 10 1 37.626 75.253 0.396 3.61 8 28.9 2.6
321 0 5 5 37.632 75.264 0.396 3.61 4 128.5 25.3
322 6 6 2 37.639 75.277 0.396 3.6 8 42.0 5.4
323 2 7 4 37.646 75.293 0.396 3.6 8 17.9 1.0
324 7 5 1 37.769 75.539 0.398 3.58 8 36.4 4.0
325 8 0 1 37.817 75.634 0.398 3.57 4 24.5 0.9
326 4 9 1 37.865 75.73 0.398 3.57 8 46.4 6.5
327 0 9 3 37.931 75.863 0.399 3.56 4 21.9 0.7
328 8 2 0 37.936 75.872 0.399 3.55 4 52.2 4.1
329 1 5 5 37.969 75.938 0.399 3.55 8 50.8 7.8
330 7 4 2 38.013 76.027 0.4 3.54 8 9.4 0.3
331 4 0 5 38.016 76.033 0.4 3.54 4 5.5 0.0
332 8 1 1 38.017 76.034 0.4 3.54 8 43.7 5.8
333 5 4 4 38.113 76.226 0.401 3.53 8 10.7 0.3
334 6 7 1 38.195 76.389 0.401 3.51 8 50.3 7.6
335 4 1 5 38.216 76.432 0.402 3.51 8 46.1 6.3
336 7 0 3 38.22 76.439 0.402 3.51 4 0.9 0.0
337 1 9 3 38.267 76.535 0.402 3.5 8 22.1 1.5
338 0 10 2 38.324 76.648 0.403 3.49 4 33.6 1.7
339 7 1 3 38.419 76.838 0.403 3.48 8 26.7 2.1
340 6 0 4 38.613 77.225 0.405 3.45 4 33.9 1.7
341 8 2 1 38.615 77.23 0.405 3.45 8 23.5 1.6
342 3 10 0 38.626 77.252 0.405 3.44 4 15.0 0.3
343 1 10 2 38.659 77.318 0.405 3.44 8 29.7 2.6
344 6 1 4 38.811 77.623 0.407 3.42 8 26.5 2.0
345 4 2 5 38.813 77.626 0.407 3.42 8 16.0 0.7
346 6 5 3 38.842 77.684 0.407 3.41 8 60.0 10.4
347 3 4 5 38.857 77.714 0.407 3.41 8 47.4 6.5
348 8 3 0 38.931 77.863 0.408 3.4 4 83.8 10.2
349 2 5 5 38.974 77.947 0.408 3.39 8 66.9 12.9
350 7 2 3 39.015 78.03 0.409 3.39 8 58.5 9.9
351 4 6 4 39.079 78.158 0.409 3.38 8 30.3 2.6
352 2 9 3 39.27 78.539 0.411 3.35 8 44.9 5.8
353 7 6 0 39.28 78.561 0.411 3.35 4 80.8 9.3
354 0 8 4 39.293 78.585 0.411 3.35 4 78.4 8.8
355 3 10 1 39.301 78.603 0.411 3.35 8 14.3 0.6
356 3 7 4 39.321 78.642 0.411 3.34 8 101.0 29.0
357 6 2 4 39.405 78.811 0.412 3.33 8 8.0 0.2
358 5 8 2 39.527 79.053 0.413 3.32 8 15.7 0.7
359 8 3 1 39.605 79.211 0.414 3.31 8 12.3 0.4
360 1 8 4 39.625 79.25 0.414 3.3 8 91.5 23.5
361 2 10 2 39.658 79.317 0.414 3.3 8 67.4 12.8
362 7 5 2 39.799 79.598 0.415 3.28 8 33.6 3.1
363 4 3 5 39.802 79.604 0.416 3.28 8 36.2 3.7
364 0 6 5 39.818 79.635 0.416 3.28 4 96.7 13.0
365 8 0 2 39.846 79.692 0.416 3.27 4 56.6 4.5
366 4 9 2 39.893 79.786 0.416 3.27 8 78.5 17.1
367 5 5 4 39.897 79.795 0.416 3.27 8 62.3 10.8
368 4 8 3 39.9 79.799 0.416 3.27 8 35.3 3.5
369 5 7 3 39.928 79.855 0.417 3.26 8 30.4 2.6
370 7 6 1 39.953 79.906 0.417 3.26 8 45.4 5.7
371 7 3 3 40.003 80.005 0.417 3.25 8 58.2 9.4
372 8 1 2 40.043 80.086 0.418 3.25 8 36.7 3.7
373 0 0 6 40.108 80.215 0.418 3.24 2 84.0 4.9
374 1 11 0 40.117 80.233 0.418 3.24 4 66.6 6.1
375 1 6 5 40.149 80.298 0.419 3.24 8 9.3 0.2
376 5 9 0 40.192 80.383 0.419 3.23 4 70.3 6.8
377 6 7 2 40.218 80.436 0.419 3.23 8 29.9 2.5
378 0 1 6 40.304 80.609 0.42 3.22 4 59.2 4.8
379 8 4 0 40.313 80.626 0.42 3.22 4 14.8 0.3
380 6 3 4 40.391 80.781 0.421 3.21 8 53.7 7.9
381 1 0 6 40.438 80.877 0.421 3.2 4 13.8 0.3
382 0 11 1 40.456 80.911 0.421 3.2 4 7.6 0.1
383 6 8 0 40.488 80.976 0.421 3.2 4 42.2 2.4
384 2 8 4 40.618 81.236 0.423 3.18 8 47.3 6.1
385 3 5 5 40.632 81.265 0.423 3.18 8 17.0 0.8
386 8 2 2 40.632 81.265 0.423 3.18 8 47.9 6.2
387 1 1 6 40.635 81.269 0.423 3.18 8 33.1 3.0
388 1 11 1 40.786 81.571 0.424 3.16 8 24.9 1.7
389 5 9 1 40.86 81.72 0.425 3.15 8 43.6 5.1
390 0 2 6 40.893 81.786 0.425 3.15 4 43.8 2.6
391 3 9 3 40.925 81.851 0.425 3.15 8 20.0 1.1
392 4 10 0 40.948 81.897 0.425 3.14 4 16.4 0.4
393 8 4 1 40.981 81.963 0.426 3.14 8 74.8 15.0
394 5 0 5 41.009 82.017 0.426 3.14 4 46.3 2.9
395 6 6 3 41.009 82.018 0.426 3.14 8 30.0 2.4
396 2 11 0 41.107 82.214 0.427 3.13 4 95.6 12.2
397 2 6 5 41.139 82.278 0.427 3.12 8 49.3 6.5
398 6 8 1 41.155 82.311 0.427 3.12 8 28.7 2.2
399 4 4 5 41.176 82.353 0.427 3.12 8 8.2 0.2
400 5 1 5 41.204 82.409 0.428 3.12 8 45.2 5.4
401 1 2 6 41.222 82.445 0.428 3.11 8 31.2 2.6
402 3 10 2 41.31 82.621 0.429 3.11 8 39.6 4.1
403 7 4 3 41.375 82.751 0.429 3.1 8 39.2 4.1
404 2 0 6 41.427 82.854 0.429 3.09 4 91.5 11.0
405 8 3 2 41.611 83.222 0.431 3.08 8 75.5 14.9
406 4 10 1 41.615 83.229 0.431 3.07 8 26.1 1.8
407 2 1 6 41.622 83.245 0.431 3.07 8 37.5 3.7
408 4 7 4 41.634 83.268 0.431 3.07 8 23.1 1.4
409 0 10 3 41.68 83.359 0.432 3.07 4 56.5 4.2
410 6 4 4 41.761 83.522 0.432 3.06 8 10.6 0.3
411 2 11 1 41.773 83.545 0.432 3.06 8 33.7 3.0
412 5 2 5 41.79 83.581 0.433 3.06 8 59.7 9.3
413 7 7 0 41.833 83.665 0.433 3.05 4 68.7 6.1
414 0 3 6 41.87 83.741 0.433 3.05 4 10.9 0.2
415 7 6 2 41.955 83.909 0.434 3.04 8 57.6 8.6
416 1 10 3 42.008 84.016 0.434 3.04 8 37.7 3.7
417 5 6 4 42.052 84.104 0.435 3.03 8 37.6 3.6
418 8 5 0 42.074 84.148 0.435 3.03 4 13.0 0.2
419 1 3 6 42.198 84.397 0.436 3.02 8 27.1 1.9
420 2 2 6 42.208 84.415 0.436 3.02 8 27.1 1.9
421 3 8 4 42.262 84.525 0.437 3.01 8 46.6 5.6
422 0 7 5 42.363 84.726 0.437 3.01 4 44.9 2.6
423 0 11 2 42.453 84.906 0.438 3.0 4 1.0 0.0
424 7 7 1 42.496 84.993 0.439 2.99 8 10.9 0.3
425 0 9 4 42.624 85.248 0.44 2.98 4 51.7 3.4
426 1 7 5 42.69 85.381 0.44 2.98 8 26.4 1.8
427 8 5 1 42.737 85.474 0.441 2.97 8 45.2 5.2
428 3 11 0 42.748 85.496 0.441 2.97 4 24.3 0.7
429 5 3 5 42.764 85.529 0.441 2.97 8 66.8 11.3
430 3 6 5 42.78 85.56 0.441 2.97 8 36.2 3.3
431 1 11 2 42.78 85.56 0.441 2.97 8 40.8 4.2
432 5 9 2 42.854 85.708 0.441 2.97 8 29.1 2.1
433 5 8 3 42.861 85.721 0.442 2.96 8 35.2 3.1
434 7 0 4 42.905 85.809 0.442 2.96 4 22.1 0.6
435 4 5 5 42.931 85.862 0.442 2.96 8 56.1 7.9
436 1 9 4 42.951 85.902 0.442 2.96 8 13.8 0.5
437 9 1 0 42.97 85.94 0.442 2.96 4 18.7 0.4
438 8 4 2 42.974 85.949 0.442 2.96 8 25.8 1.7
439 2 10 3 42.99 85.981 0.443 2.95 8 26.4 1.8
440 3 0 6 43.066 86.132 0.443 2.95 4 42.5 2.3
441 7 1 4 43.099 86.198 0.444 2.95 8 53.5 7.2
442 7 5 3 43.129 86.258 0.444 2.94 8 10.8 0.3
443 6 8 2 43.147 86.295 0.444 2.94 8 35.1 3.1
444 8 0 3 43.175 86.35 0.444 2.94 4 36.2 1.6
445 2 3 6 43.18 86.361 0.444 2.94 8 39.3 3.9
446 4 9 3 43.222 86.443 0.445 2.94 8 48.3 5.8
447 0 4 6 43.233 86.465 0.445 2.94 4 42.9 2.3
448 3 1 6 43.26 86.521 0.445 2.93 8 13.6 0.5
449 8 1 3 43.369 86.739 0.446 2.93 8 58.7 8.6
450 3 11 1 43.41 86.82 0.446 2.92 8 72.4 13.0
451 9 0 1 43.437 86.875 0.446 2.92 4 67.1 5.6
452 6 5 4 43.512 87.024 0.447 2.92 8 25.3 1.6
453 6 7 3 43.542 87.084 0.447 2.91 8 74.9 13.9
454 9 2 0 43.553 87.105 0.447 2.91 4 39.3 1.9
455 1 4 6 43.559 87.119 0.447 2.91 8 51.2 6.5
456 4 10 2 43.604 87.207 0.448 2.91 8 10.6 0.3
457 9 1 1 43.632 87.263 0.448 2.91 8 28.9 2.1
458 2 7 5 43.671 87.342 0.448 2.91 8 58.0 8.3
459 7 2 4 43.682 87.363 0.448 2.91 8 41.5 4.3
460 2 11 2 43.761 87.522 0.449 2.9 8 11.8 0.3
461 6 9 0 43.802 87.605 0.449 2.9 4 43.4 2.3
462 3 2 6 43.843 87.686 0.45 2.89 8 37.7 3.5
463 5 10 0 43.898 87.796 0.45 2.89 4 12.8 0.2
464 2 9 4 43.931 87.863 0.45 2.89 8 48.7 5.8
465 8 2 3 43.952 87.903 0.451 2.89 8 19.8 1.0
466 5 4 5 44.124 88.248 0.452 2.88 8 29.1 2.1
467 8 6 0 44.212 88.424 0.453 2.87 4 15.2 0.3
468 9 2 1 44.214 88.427 0.453 2.87 8 63.3 9.8
469 0 12 0 44.274 88.547 0.453 2.87 2 25.2 0.4
470 6 9 1 44.463 88.926 0.455 2.86 8 38.9 3.7
471 7 7 2 44.481 88.962 0.455 2.86 8 76.2 14.1
472 9 3 0 44.523 89.045 0.455 2.85 4 21.5 0.6
473 2 4 6 44.539 89.078 0.455 2.85 8 11.8 0.3
474 4 8 4 44.55 89.1 0.455 2.85 8 28.1 1.9
475 5 10 1 44.559 89.117 0.455 2.85 8 20.6 1.0
476 5 7 4 44.578 89.156 0.456 2.85 8 77.9 14.7
477 1 12 0 44.6 89.2 0.456 2.85 4 0.2 0.0
478 6 0 5 44.61 89.22 0.456 2.85 4 1.9 0.0
479 3 10 3 44.623 89.246 0.456 2.85 8 30.5 2.3
480 7 3 4 44.652 89.303 0.456 2.85 8 61.5 9.2
481 8 5 2 44.721 89.442 0.457 2.84 8 39.9 3.9
482 7 8 0 44.748 89.495 0.457 2.84 4 45.5 2.5
483 6 1 5 44.804 89.608 0.457 2.84 8 45.7 5.0
484 3 3 6 44.813 89.625 0.457 2.84 8 26.6 1.7
485 8 6 1 44.872 89.745 0.458 2.83 8 44.2 4.7
486 8 3 3 44.921 89.843 0.458 2.83 8 42.1 4.3
487 0 12 1 44.934 89.869 0.458 2.83 4 1.7 0.0
488 0 5 6 44.979 89.958 0.459 2.83 4 47.3 2.7
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 1 0 5.467 10.935 8.08443 554.0 48.6 48.7 5.6
2 0 2 0 6.681 13.363 6.6205 638.0 56.0 56.0 5.6
3 0 1 1 7.014 14.029 6.30768 62.3 5.5 5.5 5.6
4 1 0 1 7.541 15.082 5.86949 1140.2 100.0 100.0 5.6
5 1 1 1 8.253 16.507 5.36592 103.4 9.1 9.1 5.6
6 2 0 0 8.68 17.36 5.104 295.5 25.9 25.9 5.6
7 0 2 1 9.109 18.219 4.86533 134.9 11.8 11.8 5.6
8 1 2 1 10.101 20.202 4.39198 472.5 41.4 41.3 5.6
9 2 0 1 10.674 21.347 4.15885 33.8 3.0 3.0 5.6
10 1 3 0 10.961 21.921 4.0512 175.6 15.4 15.3 5.6
11 2 1 1 11.194 22.388 3.96774 31.5 2.8 2.7 5.6
12 0 0 2 12.4 24.801 3.587 200.4 17.6 17.5 5.6
13 1 3 1 12.613 25.225 3.5276 229.7 20.1 20.0 5.6
14 0 1 2 12.855 25.71 3.46221 59.7 5.2 5.2 5.6
15 1 0 2 13.157 26.313 3.38415 13.2 1.2 1.1 5.6
16 2 3 0 13.34 26.679 3.33853 21.5 1.9 1.9 5.6
17 0 4 0 13.456 26.912 3.31025 12.6 1.1 1.1 5.6
18 3 1 0 13.517 27.034 3.29559 332.0 29.1 28.9 5.6
19 1 1 2 13.588 27.175 3.27876 49.1 4.3 4.3 5.6
20 1 4 0 14.16 28.319 3.14883 74.9 6.6 6.5 5.6
21 3 0 1 14.51 29.02 3.07438 301.2 26.4 26.2 5.6
22 3 2 0 14.745 29.491 3.02635 189.4 16.6 16.4 5.6
23 1 2 2 14.811 29.621 3.0133 171.1 15.0 14.8 5.6
24 0 4 1 14.849 29.698 3.0057 828.9 72.7 71.9 5.6
25 3 1 1 14.905 29.81 2.99472 292.5 25.7 25.4 5.6
26 2 0 2 15.217 30.433 2.93474 525.7 46.1 45.6 5.6
27 1 4 1 15.495 30.99 2.88331 300.1 26.3 26.0 5.6
28 2 1 2 15.595 31.19 2.86521 555.6 48.7 48.2 5.6
29 3 2 1 16.036 32.072 2.7884 116.7 10.2 10.1 5.6
30 2 4 0 16.102 32.204 2.77728 126.9 11.1 11.0 5.6
31 3 3 0 16.609 33.218 2.69481 34.4 3.0 3.0 5.6
32 1 3 2 16.668 33.335 2.68558 120.8 10.6 10.5 5.7
33 2 4 1 17.302 34.604 2.58998 134.5 11.8 11.6 5.7
34 1 5 0 17.488 34.975 2.56335 82.1 7.2 7.1 5.7
35 3 3 1 17.779 35.557 2.5227 173.1 15.2 14.9 5.7
36 4 1 0 17.902 35.804 2.50588 53.6 4.7 4.6 5.7
37 2 3 2 18.373 36.745 2.44382 18.7 1.6 1.6 5.7
38 3 1 2 18.506 37.012 2.42683 127.6 11.2 11.0 5.7
39 4 0 1 18.685 37.37 2.4044 49.7 4.4 4.3 5.7
40 3 4 0 18.944 37.888 2.3727 49.6 4.4 4.3 5.7
41 1 4 2 18.996 37.993 2.36639 129.5 11.4 11.2 5.7
42 0 1 3 19.106 38.213 2.35326 25.5 2.2 2.2 5.7
43 1 0 3 19.319 38.639 2.3283 106.2 9.3 9.1 5.7
44 3 2 2 19.452 38.903 2.31307 30.0 2.6 2.6 5.7
45 1 1 3 19.628 39.256 2.29312 17.6 1.5 1.5 5.7
46 4 2 1 19.928 39.856 2.25997 13.2 1.2 1.1 5.7
47 0 2 3 20.028 40.056 2.24911 11.9 1.0 1.0 5.7
48 2 5 1 20.172 40.343 2.23378 105.0 9.2 9.0 5.7
49 1 2 3 20.53 41.06 2.19643 72.0 6.3 6.2 5.7
50 2 0 3 20.837 41.674 2.16544 55.1 4.8 4.7 5.7
51 1 6 0 20.923 41.845 2.157 166.1 14.6 14.3 5.7
52 2 1 3 21.127 42.254 2.13705 21.6 1.9 1.8 5.7
53 0 6 1 21.419 42.838 2.10929 19.2 1.7 1.6 5.7
54 4 0 2 21.742 43.484 2.07943 46.8 4.1 4.0 5.7
55 1 6 1 21.895 43.789 2.06565 15.4 1.3 1.3 5.7
56 2 2 3 21.979 43.957 2.05815 23.3 2.0 2.0 5.7
57 4 1 2 22.022 44.045 2.05425 137.8 12.1 11.8 5.7
58 2 6 0 22.351 44.701 2.0256 55.7 4.9 4.8 5.7
59 3 5 1 22.575 45.151 2.00646 86.1 7.6 7.4 5.7
60 3 4 2 22.907 45.814 1.97894 14.8 1.3 1.3 5.7
61 2 5 2 23.066 46.131 1.96608 14.1 1.2 1.2 5.7
62 3 0 3 23.185 46.37 1.9565 40.0 3.5 3.4 5.7
63 2 6 1 23.275 46.549 1.94939 75.5 6.6 6.4 5.7
64 5 1 1 23.363 46.727 1.94239 58.5 5.1 5.0 5.7
65 3 1 3 23.452 46.904 1.93548 69.1 6.1 5.9 5.7
66 1 4 3 23.858 47.716 1.90441 18.8 1.6 1.6 5.7
67 4 3 2 24.172 48.345 1.88111 80.1 7.0 6.8 5.7
68 3 2 3 24.238 48.477 1.87628 17.4 1.5 1.5 5.7
69 1 7 0 24.466 48.932 1.85991 21.5 1.9 1.8 5.7
70 1 6 2 24.626 49.253 1.84852 83.0 7.3 7.1 5.7
71 2 4 3 25.155 50.31 1.81215 125.9 11.0 10.7 5.8
72 3 5 2 25.25 50.501 1.80574 40.9 3.6 3.5 5.8
73 1 7 1 25.331 50.661 1.80039 12.4 1.1 1.1 5.8
74 5 3 1 25.426 50.852 1.79409 166.9 14.6 14.2 5.8
75 3 3 3 25.509 51.018 1.78864 94.9 8.3 8.1 5.8
76 4 5 1 25.64 51.279 1.78013 147.1 12.9 12.5 5.8
77 0 5 3 25.722 51.444 1.77481 23.2 2.0 2.0 5.8
78 1 0 4 25.853 51.706 1.76644 14.8 1.3 1.3 5.8
79 5 1 2 25.977 51.953 1.75861 43.7 3.8 3.7 5.8
80 1 1 4 26.099 52.198 1.75093 31.9 2.8 2.7 5.8
81 0 2 4 26.421 52.842 1.7311 19.4 1.7 1.6 5.8
82 2 7 1 26.574 53.149 1.72184 28.9 2.5 2.4 5.8
83 2 0 4 27.08 54.159 1.69207 89.5 7.8 7.6 5.8
84 6 1 0 27.16 54.319 1.68746 84.0 7.4 7.1 5.8
85 3 4 3 27.215 54.43 1.6843 23.8 2.1 2.0 5.8
86 2 1 4 27.318 54.636 1.67843 21.2 1.9 1.8 5.8
87 2 5 3 27.355 54.709 1.67635 88.0 7.7 7.4 5.8
88 0 8 0 27.736 55.471 1.65512 36.9 3.2 3.1 5.8
89 3 7 0 27.769 55.538 1.65328 22.6 2.0 1.9 5.8
90 1 7 2 27.808 55.616 1.65115 19.8 1.7 1.7 5.8
91 5 3 2 27.897 55.795 1.64628 54.4 4.8 4.6 5.8
92 6 1 1 27.965 55.93 1.64263 32.9 2.9 2.8 5.8
93 1 3 4 28.014 56.028 1.63998 31.0 2.7 2.6 5.8
94 4 5 2 28.098 56.196 1.63548 27.4 2.4 2.3 5.8
95 1 8 0 28.13 56.259 1.63379 93.3 8.2 7.9 5.8
96 4 3 3 28.338 56.677 1.62275 33.1 2.9 2.8 5.8
97 1 6 3 28.745 57.491 1.60169 18.2 1.6 1.5 5.8
98 1 8 1 28.917 57.834 1.593 14.6 1.3 1.2 5.8
99 0 4 4 29.24 58.48 1.57692 17.5 1.5 1.5 5.8
100 5 4 2 29.509 59.017 1.56384 12.9 1.1 1.1 5.8
101 1 4 4 29.621 59.243 1.55844 29.8 2.6 2.5 5.8
102 6 3 1 29.799 59.598 1.54998 42.5 3.7 3.6 5.8
103 2 6 3 29.892 59.783 1.54563 29.6 2.6 2.5 5.8
104 4 4 3 29.934 59.869 1.54363 24.1 2.1 2.0 5.8
105 5 1 3 29.966 59.933 1.54213 69.0 6.1 5.8 5.8
106 2 8 1 30.059 60.118 1.53782 51.8 4.5 4.3 5.8
107 6 1 2 30.296 60.591 1.52693 39.7 3.5 3.3 5.8
108 2 4 4 30.747 61.495 1.50665 19.7 1.7 1.6 5.8
109 3 7 2 30.865 61.73 1.50147 47.2 4.1 3.9 5.8
110 6 2 2 30.959 61.918 1.49736 24.8 2.2 2.1 5.8
111 1 8 2 31.203 62.406 1.48683 74.1 6.5 6.2 5.8
112 6 4 1 31.349 62.698 1.4806 14.9 1.3 1.2 5.8
113 5 5 2 31.504 63.008 1.47405 54.4 4.8 4.5 5.9
114 1 7 3 31.646 63.292 1.46813 24.0 2.1 2.0 5.9
115 5 3 3 31.728 63.457 1.46471 55.7 4.9 4.6 5.9
116 4 1 4 31.881 63.761 1.45844 45.0 3.9 3.8 5.9
117 4 5 3 31.914 63.828 1.45708 59.1 5.2 4.9 5.9
118 6 3 2 32.047 64.094 1.45167 22.3 2.0 1.9 5.9
119 2 8 2 32.297 64.593 1.44166 45.0 3.9 3.8 5.9
120 3 4 4 32.573 65.146 1.43074 19.0 1.7 1.6 5.9
121 1 0 5 32.829 65.658 1.42083 36.8 3.2 3.1 5.9
122 1 1 5 33.041 66.083 1.41272 31.5 2.8 2.6 5.9
123 6 5 1 33.281 66.561 1.40372 33.7 3.0 2.8 5.9
124 7 2 1 33.465 66.93 1.39689 29.8 2.6 2.5 5.9
125 4 3 4 33.586 67.172 1.39244 15.6 1.4 1.3 5.9
126 1 2 5 33.675 67.349 1.3892 11.8 1.0 1.0 5.9
127 5 7 0 33.72 67.44 1.38755 41.5 3.6 3.4 5.9
128 1 6 4 33.956 67.912 1.37906 18.8 1.6 1.6 5.9
129 3 8 2 34.077 68.155 1.37474 45.2 4.0 3.7 5.9
130 0 8 3 34.471 68.942 1.36094 29.4 2.6 2.4 5.9
131 7 3 1 34.511 69.022 1.35957 31.2 2.7 2.6 5.9
132 1 3 5 34.718 69.435 1.35248 17.9 1.6 1.5 5.9
133 1 9 2 34.813 69.626 1.34924 18.1 1.6 1.5 5.9
134 5 1 4 35.073 70.146 1.3405 19.0 1.7 1.6 5.9
135 6 6 1 35.568 71.137 1.32425 11.8 1.0 1.0 5.9
136 0 4 5 35.811 71.622 1.31646 26.0 2.3 2.1 5.9
137 2 8 3 35.857 71.714 1.315 15.3 1.3 1.3 5.9
138 1 4 5 36.154 72.309 1.30564 18.9 1.7 1.6 5.9
139 5 7 2 36.528 73.057 1.29411 42.7 3.7 3.5 6.0
140 1 7 4 36.629 73.259 1.29104 11.6 1.0 1.0 6.0
141 3 6 4 36.723 73.445 1.28822 14.0 1.2 1.1 6.0
142 4 7 3 36.911 73.822 1.28258 21.6 1.9 1.8 6.0
143 6 4 3 37.042 74.084 1.27868 13.6 1.2 1.1 6.0
144 7 5 0 37.085 74.17 1.27741 14.9 1.3 1.2 6.0
145 4 9 0 37.181 74.362 1.27459 33.6 2.9 2.8 6.0
146 3 3 5 37.46 74.92 1.26647 15.8 1.4 1.3 6.0
147 3 8 3 37.559 75.119 1.26362 13.1 1.1 1.1 6.0
148 6 6 2 37.639 75.277 1.26135 34.3 3.0 2.8 6.0
149 6 7 1 38.195 76.389 1.24573 13.9 1.2 1.1 6.0
150 6 5 3 38.842 77.684 1.22818 17.0 1.5 1.4 6.0
151 2 5 5 38.974 77.947 1.22468 12.9 1.1 1.1 6.0
152 3 7 4 39.321 78.642 1.2156 52.8 4.6 4.3 6.0
153 1 8 4 39.625 79.25 1.20779 23.5 2.1 1.9 6.0
154 2 10 2 39.658 79.317 1.20694 12.8 1.1 1.0 6.0
155 0 6 5 39.818 79.635 1.20291 24.3 2.1 2.0 6.0
156 4 9 2 39.893 79.786 1.20102 31.4 2.8 2.5 6.0
157 8 2 2 40.632 81.265 1.18286 16.0 1.4 1.3 6.1
158 8 4 1 40.981 81.963 1.17454 20.2 1.8 1.6 6.1
159 2 11 0 41.107 82.214 1.17159 12.2 1.1 1.0 6.1
160 8 3 2 41.611 83.222 1.15994 21.8 1.9 1.7 6.1
161 5 2 5 41.79 83.581 1.15587 12.2 1.1 1.0 6.1
162 5 3 5 42.764 85.529 1.13446 24.7 2.2 2.0 6.1
163 3 11 1 43.41 86.82 1.12087 18.6 1.6 1.5 6.1
164 6 7 3 43.542 87.084 1.11815 23.9 2.1 1.9 6.1
165 2 7 5 43.671 87.342 1.11551 12.6 1.1 1.0 6.2
166 7 7 2 44.481 88.962 1.09934 17.8 1.6 1.4 6.2
167 5 7 4 44.578 89.156 1.09746 17.7 1.5 1.4 6.2
168 7 3 4 44.652 89.303 1.09603 11.4 1.0 0.9 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)
|