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 ***
***********************
KAMCHATKITE
1
KCu(3)OCl[SO(4)](2)
Orthorhombic P na2(1) Z = 4
R =0.055 NR =1430
19 .1 .1993
Ref.Str.:
Varaksina T.V., Fundamensky V.S., Filatov S.K. (1990)
* Mineral. Mag., 54, 613-616
Reserv:
S.O.L.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 9.741 alpha = 90.0
b = 12.858 beta = 90.0
c = 7.001 gamma = 90.0
Unit cell volume (cub. angs.) = 876.87
Molar volume ( cub.cm/mol.) = 132.04
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.152 0.1491 0.8363 0.97 Cu = 1.00
2 0.2221 0.9074 0.8353 0.95 Cu = 1.00
3 0.9988 0.9991 0.0811 0.88 Cu = 1.00
4 0.1694 0.8542 0.3394 0.81 S = 1.00
5 0.071 0.2097 0.3353 0.92 S = 1.00
6 0.1346 0.5745 0.8472 2.19 K = 1.00
7 0.1759 0.925 0.5069 1.0 O = 1.00
8 0.0455 0.7907 0.3188 1.03 O = 1.00
9 0.2065 0.293 0.8423 1.32 O = 1.00
10 0.1722 0.9221 0.1645 1.7 O = 1.00
11 0.0793 0.7888 0.8458 1.1 O = 1.00
12 0.1287 0.1569 0.4991 1.6 O = 1.00
13 0.1154 0.3211 0.3509 1.35 O = 1.00
14 0.1171 0.154 0.1623 0.9 O = 1.00
15 0.0797 0.0101 0.8227 0.7 O = 1.00
16 0.1344 0.5586 0.3396 1.68 Cl = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.152 0.1491 0.8363
2 2 0.2221 0.9074 0.8353
3 3 0.9988 0.9991 0.0811
4 4 0.1694 0.8542 0.3394
5 5 0.071 0.2097 0.3353
6 6 0.1346 0.5745 0.8472
7 7 0.1759 0.925 0.5069
8 8 0.0455 0.7907 0.3188
9 9 0.2065 0.293 0.8423
10 10 0.1722 0.9221 0.1645
11 11 0.0793 0.7888 0.8458
12 12 0.1287 0.1569 0.4991
13 13 0.1154 0.3211 0.3509
14 14 0.1171 0.154 0.1623
15 15 0.0797 0.0101 0.8227
16 16 0.1344 0.5586 0.3396
17 1 0.848 0.8509 0.3363
18 2 0.7779 0.0926 0.3353
19 3 0.0012 0.0009 0.5811
20 4 0.8306 0.1458 0.8394
21 5 0.929 0.7903 0.8353
22 6 0.8654 0.4255 0.3472
23 7 0.8241 0.075 0.0069
24 8 0.9545 0.2093 0.8188
25 9 0.7935 0.707 0.3423
26 10 0.8278 0.0779 0.6645
27 11 0.9207 0.2112 0.3458
28 12 0.8713 0.8431 0.9991
29 13 0.8846 0.6789 0.8509
30 14 0.8829 0.846 0.6623
31 15 0.9203 0.9899 0.3227
32 16 0.8656 0.4414 0.8396
33 1 0.348 0.6491 0.3363
34 2 0.2779 0.4074 0.3353
35 3 0.5012 0.4991 0.5811
36 4 0.3306 0.3542 0.8394
37 5 0.429 0.7097 0.8353
38 6 0.3654 0.0745 0.3472
39 7 0.3241 0.425 0.0069
40 8 0.4545 0.2907 0.8188
41 9 0.2935 0.793 0.3423
42 10 0.3278 0.4221 0.6645
43 11 0.4207 0.2888 0.3458
44 12 0.3713 0.6569 0.9991
45 13 0.3846 0.8211 0.8509
46 14 0.3829 0.654 0.6623
47 15 0.4203 0.5101 0.3227
48 16 0.3656 0.0586 0.8396
49 1 0.652 0.3509 0.8363
50 2 0.7221 0.5926 0.8353
51 3 0.4988 0.5009 0.0811
52 4 0.6694 0.6458 0.3394
53 5 0.571 0.2903 0.3353
54 6 0.6346 0.9255 0.8472
55 7 0.6759 0.575 0.5069
56 8 0.5455 0.7093 0.3188
57 9 0.7065 0.207 0.8423
58 10 0.6722 0.5779 0.1645
59 11 0.5793 0.7112 0.8458
60 12 0.6287 0.3431 0.4991
61 13 0.6154 0.1789 0.3509
62 14 0.6171 0.346 0.1623
63 15 0.5797 0.4899 0.8227
64 16 0.6344 0.9414 0.3396
X-ray density (g/cm cub.) = 3.58
MU (1/cm) = 202.96 Mass attenuation coefficient (cm**2/g) = 56.63
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Cu 3.348 6
1.9249 9
2.3737 12
2.3084 14
1.9239 15
2.0772 8
2.3843 16
2 Cu 3.348 6
2.3537 7
2.363 10
2.0653 11
1.9173 15
1.9361 13
2.3948 16
3 Cu 3.348 9
3.1869 8
2.0431 10
3.262 11
2.3702 14
1.9783 15
2.0293 7
3.296 8
2.4281 12
1.86 15
4 S 2.52 4
1.4859 7
1.4643 8
1.5041 10
1.4426 9
5 S 2.52 4
1.4463 12
1.5002 13
1.477 14
1.466 11
6 K 3.768 10
3.6868 9
2.8076 11
3.4534 16
3.5596 16
2.7808 13
3.1302 16
2.8901 7
3.0029 10
2.7513 12
2.9276 14
7 O 3.804 10
2.5159 8
2.3977 10
3.0954 11
3.0175 12
2.6389 15
3.2189 14
2.9255 15
2.3497 9
3.4231 13
3.4338 16
8 O 3.804 10
2.5159 7
2.3547 10
3.7043 11
3.3279 11
3.1109 16
2.6853 9
2.8884 12
2.9661 14
2.837 15
2.4215 9
9 O 3.804 9
3.0676 12
3.6874 13
3.5712 13
2.9953 14
2.6853 8
2.3497 7
2.4215 8
2.3877 10
3.3891 16
10 O 3.804 10
2.3977 7
2.3547 8
2.9555 11
3.0297 14
2.7961 15
3.3112 12
2.8298 15
2.3877 9
3.2844 13
3.4356 16
11 O 3.804 11
3.0954 7
3.3279 8
3.7043 8
2.9555 10
2.8501 15
2.3968 12
2.3654 13
2.419 14
3.4812 12
3.003 13
3.6607 14
12 O 3.804 11
3.0175 7
3.0676 9
2.356 13
2.3609 14
2.9872 15
2.8884 8
3.3112 10
2.3968 11
3.2027 15
3.4812 11
3.5504 16
13 O 3.804 9
3.5712 9
3.6874 9
2.356 12
2.5219 14
3.0604 16
2.3654 11
3.4231 7
3.2844 10
3.003 11
14 O 3.804 11
2.9953 9
3.0297 10
2.3609 12
2.5219 13
3.0346 15
3.2189 7
2.9661 8
2.419 11
3.064 15
3.6607 11
3.531 16
15 O 3.804 11
2.6389 7
2.7961 10
2.8501 11
2.9872 12
3.0346 14
2.9255 7
2.837 8
2.8298 10
3.2027 12
3.064 14
2.8564 16
16 Cl 4.344 9
3.1109 8
3.0604 13
3.8299 9
3.4338 7
3.3891 9
3.4356 10
3.5504 12
3.531 14
2.8564 15
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 5.693 11.387 0.064 200.24 4 183.4 3504.0
2 0 2 0 6.881 13.763 0.078 136.36 2 79.3 223.2
3 0 1 1 7.197 14.393 0.081 124.48 4 6.8 3.0
4 1 2 0 8.254 16.507 0.093 94.11 4 20.8 21.1
5 1 1 1 8.519 17.039 0.096 88.19 8 77.4 549.8
6 2 0 0 9.1 18.199 0.103 77.03 2 34.4 23.7
7 2 1 0 9.737 19.473 0.11 67.01 4 39.4 54.2
8 1 2 1 10.42 20.841 0.117 58.23 8 57.6 200.9
9 2 0 1 11.108 22.216 0.125 50.99 4 15.3 6.2
10 1 3 0 11.323 22.647 0.127 48.99 4 59.9 91.4
11 2 2 0 11.444 22.888 0.129 47.91 4 21.3 11.3
12 2 1 1 11.64 23.28 0.131 46.25 8 53.2 136.0
13 0 3 1 12.165 24.33 0.137 42.16 4 3.9 0.3
14 0 0 2 12.712 25.424 0.143 38.44 2 388.4 1508.7
15 1 3 1 13.007 26.014 0.146 36.62 8 3.9 0.6
16 2 2 1 13.113 26.226 0.147 36.0 8 44.4 73.8
17 2 3 0 13.851 27.702 0.155 32.06 4 166.9 464.6
18 0 4 0 13.865 27.729 0.156 31.99 2 72.4 43.7
19 1 1 2 13.968 27.936 0.157 31.49 8 88.1 254.5
20 3 1 0 14.163 28.325 0.159 30.58 4 12.1 2.3
21 0 2 2 14.51 29.02 0.163 29.04 4 128.4 249.1
22 1 4 0 14.616 29.232 0.164 28.59 4 37.4 20.8
23 1 2 2 15.232 30.465 0.171 26.17 8 11.5 3.6
24 2 3 1 15.276 30.552 0.171 26.01 8 88.8 213.4
25 3 2 0 15.413 30.825 0.173 25.52 4 181.8 438.9
26 3 1 1 15.562 31.123 0.174 24.99 8 33.0 28.3
27 2 0 2 15.723 31.446 0.176 24.44 4 177.3 399.5
28 1 4 1 15.979 31.957 0.179 23.61 8 3.1 0.2
29 2 1 2 16.113 32.226 0.18 23.19 8 6.6 1.0
30 2 4 0 16.685 33.37 0.186 21.5 4 240.6 647.4
31 3 2 1 16.717 33.434 0.187 21.41 8 98.6 216.4
32 1 3 2 17.152 34.305 0.191 20.24 8 185.1 721.8
33 2 2 2 17.235 34.47 0.192 20.03 8 134.0 374.5
34 3 3 0 17.315 34.629 0.193 19.83 4 230.3 547.1
35 2 4 1 17.907 35.814 0.2 18.43 8 43.6 36.4
36 1 5 0 18.047 36.094 0.201 18.11 4 168.8 268.6
37 4 0 0 18.44 36.879 0.205 17.28 2 109.5 53.9
38 3 3 1 18.5 37.0 0.206 17.15 8 32.3 18.6
39 0 5 1 18.609 37.217 0.207 16.93 4 101.7 91.2
40 4 1 0 18.78 37.559 0.209 16.6 4 38.1 12.6
41 2 3 2 18.976 37.951 0.211 16.22 8 103.8 182.0
42 0 4 2 18.986 37.972 0.211 16.2 4 175.5 259.7
43 1 5 1 19.193 38.386 0.213 15.82 8 67.1 74.1
44 3 1 2 19.212 38.425 0.214 15.78 8 87.7 126.2
45 1 4 2 19.561 39.122 0.217 15.17 8 41.5 27.2
46 4 0 1 19.566 39.132 0.217 15.16 4 103.0 83.7
47 0 1 3 19.601 39.202 0.218 15.1 4 30.8 7.4
48 3 4 0 19.706 39.412 0.219 14.92 4 81.1 51.1
49 4 2 0 19.769 39.539 0.22 14.81 4 90.5 63.1
50 2 5 0 19.799 39.598 0.22 14.76 4 195.3 293.1
51 4 1 1 19.89 39.779 0.221 14.61 8 36.5 20.2
52 1 1 3 20.161 40.322 0.224 14.18 8 142.7 300.5
53 3 2 2 20.184 40.369 0.224 14.14 8 115.4 196.0
54 3 4 1 20.774 41.549 0.23 13.26 8 67.5 62.9
55 4 2 1 20.835 41.67 0.231 13.18 8 65.6 59.1
56 2 5 1 20.863 41.727 0.231 13.14 8 56.1 43.0
57 0 6 0 21.066 42.132 0.233 12.86 2 62.3 13.0
58 1 2 3 21.096 42.193 0.234 12.81 8 62.7 52.4
59 2 4 2 21.207 42.414 0.235 12.67 8 38.7 19.7
60 4 3 0 21.334 42.667 0.236 12.5 4 117.1 89.1
61 2 0 3 21.469 42.939 0.238 12.32 4 129.6 107.6
62 1 6 0 21.595 43.189 0.239 12.16 4 10.5 0.7
63 3 3 2 21.724 43.448 0.24 12.0 8 16.5 3.4
64 2 1 3 21.77 43.539 0.241 11.94 8 22.4 6.2
65 0 3 3 22.076 44.151 0.244 11.57 4 52.0 16.2
66 1 5 2 22.333 44.666 0.247 11.27 8 5.4 0.3
67 4 3 1 22.338 44.676 0.247 11.27 8 113.4 150.7
68 3 5 0 22.464 44.927 0.248 11.13 4 163.7 155.1
69 1 3 3 22.585 45.171 0.249 10.99 8 40.5 18.8
70 1 6 1 22.59 45.179 0.249 10.99 8 69.2 54.8
71 2 2 3 22.651 45.302 0.25 10.92 8 35.3 14.2
72 4 0 2 22.663 45.327 0.25 10.91 4 183.0 190.0
73 4 1 2 22.951 45.902 0.253 10.6 8 8.5 0.8
74 2 6 0 23.122 46.245 0.255 10.42 4 155.7 131.5
75 4 4 0 23.38 46.76 0.258 10.17 4 140.0 103.7
76 3 5 1 23.43 46.859 0.258 10.12 8 84.0 74.3
77 5 1 0 23.571 47.143 0.26 9.98 4 172.1 153.8
78 3 4 2 23.743 47.487 0.261 9.82 8 91.0 84.6
79 4 2 2 23.798 47.596 0.262 9.76 8 85.8 74.8
80 2 5 2 23.824 47.647 0.262 9.74 8 93.5 88.5
81 2 3 3 24.064 48.127 0.265 9.52 8 105.8 110.9
82 2 6 1 24.068 48.136 0.265 9.52 8 10.3 1.0
83 3 1 3 24.259 48.519 0.267 9.35 8 18.0 3.2
84 4 4 1 24.318 48.635 0.267 9.3 8 38.9 14.6
85 5 2 0 24.402 48.804 0.268 9.22 4 140.6 94.8
86 5 1 1 24.504 49.007 0.269 9.14 8 29.0 8.0
87 1 4 3 24.549 49.099 0.27 9.1 8 52.9 26.5
88 0 6 2 24.926 49.852 0.274 8.79 4 98.7 44.5
89 3 2 3 25.073 50.146 0.275 8.67 8 72.9 47.9
90 4 3 2 25.161 50.323 0.276 8.6 8 55.2 27.3
91 1 7 0 25.261 50.521 0.277 8.53 4 142.4 89.9
92 5 2 1 25.311 50.622 0.278 8.49 8 19.0 3.2
93 1 6 2 25.392 50.783 0.278 8.43 8 36.5 11.7
94 3 6 0 25.51 51.02 0.28 8.34 4 4.7 0.1
95 0 7 1 25.692 51.385 0.281 8.2 4 93.7 37.5
96 5 3 0 25.741 51.483 0.282 8.17 4 88.5 33.3
97 4 5 0 25.825 51.65 0.283 8.11 4 62.9 16.7
98 2 4 3 25.943 51.885 0.284 8.02 8 91.0 69.1
99 0 0 4 26.11 52.22 0.286 7.91 2 429.5 379.5
100 1 7 1 26.148 52.296 0.286 7.88 8 27.6 6.2
101 3 5 2 26.163 52.326 0.286 7.87 8 36.8 11.1
102 3 3 3 26.387 52.775 0.288 7.72 8 13.7 1.5
103 3 6 1 26.391 52.783 0.289 7.72 8 71.8 41.4
104 0 5 3 26.47 52.939 0.289 7.67 4 169.8 114.9
105 5 3 1 26.617 53.235 0.291 7.57 8 63.8 32.1
106 2 7 0 26.627 53.254 0.291 7.56 4 71.0 19.8
107 4 5 1 26.699 53.398 0.292 7.52 8 35.1 9.7
108 2 6 2 26.753 53.506 0.292 7.48 8 39.8 12.4
109 1 1 4 26.817 53.634 0.293 7.44 8 97.2 73.1
110 1 5 3 26.916 53.832 0.294 7.38 8 86.9 58.0
111 4 4 2 26.985 53.969 0.295 7.34 8 65.7 33.0
112 0 2 4 27.137 54.273 0.296 7.24 4 60.2 13.6
113 5 1 2 27.158 54.315 0.296 7.23 8 14.0 1.5
114 4 0 3 27.204 54.408 0.297 7.2 4 130.0 63.3
115 4 1 3 27.456 54.912 0.299 7.05 8 71.5 37.5
116 2 7 1 27.483 54.966 0.3 7.04 8 73.5 39.6
117 5 4 0 27.537 55.075 0.3 7.01 4 39.4 5.6
118 1 2 4 27.576 55.151 0.3 6.98 8 12.6 1.1
119 2 0 4 27.882 55.764 0.304 6.81 4 16.6 1.0
120 5 2 2 27.91 55.82 0.304 6.79 8 130.2 119.8
121 2 1 4 28.13 56.26 0.306 6.67 8 12.8 1.1
122 3 4 3 28.155 56.309 0.306 6.66 8 124.3 107.1
123 4 2 3 28.203 56.407 0.307 6.64 8 27.3 5.2
124 2 5 3 28.226 56.452 0.307 6.62 8 64.5 28.7
125 6 0 0 28.324 56.648 0.308 6.57 2 120.6 24.9
126 5 4 1 28.375 56.75 0.308 6.55 8 61.3 25.6
127 6 1 0 28.569 57.139 0.31 6.44 4 70.1 16.5
128 4 6 0 28.607 57.214 0.311 6.43 4 16.2 0.9
129 0 8 0 28.637 57.273 0.311 6.41 2 1.9 0.0
130 1 7 2 28.694 57.388 0.312 6.38 8 26.8 4.8
131 3 7 0 28.803 57.606 0.313 6.33 4 73.0 17.5
132 1 3 4 28.81 57.621 0.313 6.32 8 13.4 1.2
133 2 2 4 28.866 57.731 0.313 6.3 8 40.2 10.6
134 3 6 2 28.923 57.845 0.314 6.27 8 8.0 0.4
135 1 8 0 29.061 58.121 0.315 6.2 4 137.3 60.8
136 5 3 2 29.135 58.271 0.316 6.17 8 102.8 67.8
137 6 0 1 29.147 58.293 0.316 6.16 4 31.5 3.2
138 4 5 2 29.212 58.425 0.317 6.13 8 33.9 7.3
139 6 2 0 29.298 58.596 0.318 6.09 4 92.2 26.9
140 6 1 1 29.388 58.775 0.319 6.05 8 147.1 136.2
141 4 3 3 29.421 58.841 0.319 6.03 8 94.0 55.4
142 4 6 1 29.424 58.849 0.319 6.03 8 30.0 5.7
143 3 7 1 29.617 59.234 0.321 5.94 8 85.3 45.0
144 1 6 3 29.628 59.256 0.321 5.94 8 77.8 37.4
145 5 5 0 29.738 59.475 0.322 5.89 4 57.9 10.3
146 1 8 1 29.87 59.741 0.323 5.83 8 75.5 34.6
147 2 7 2 29.953 59.905 0.324 5.79 8 35.5 7.6
148 2 3 4 30.066 60.132 0.325 5.75 8 79.4 37.7
149 0 4 4 30.073 60.146 0.325 5.74 4 25.8 2.0
150 6 2 1 30.104 60.207 0.326 5.73 8 40.3 9.7
151 3 1 4 30.234 60.469 0.327 5.67 8 53.7 17.0
152 2 8 0 30.31 60.619 0.328 5.64 4 73.6 15.9
153 3 5 3 30.326 60.652 0.328 5.64 8 78.2 35.8
154 1 4 4 30.485 60.969 0.329 5.57 8 17.1 1.7
155 6 3 0 30.488 60.975 0.329 5.57 4 36.0 3.8
156 5 5 1 30.536 61.073 0.33 5.55 8 94.5 51.5
157 5 4 2 30.799 61.597 0.332 5.45 8 82.7 38.7
158 2 6 3 30.863 61.726 0.333 5.42 8 13.4 1.0
159 3 2 4 30.939 61.877 0.334 5.39 8 98.7 54.6
160 4 4 3 31.075 62.15 0.335 5.34 8 44.9 11.2
161 2 8 1 31.1 62.199 0.335 5.33 8 46.6 12.0
162 5 1 3 31.233 62.466 0.337 5.28 8 16.9 1.6
163 6 3 1 31.275 62.55 0.337 5.26 8 43.9 10.5
164 6 0 2 31.534 63.068 0.339 5.17 4 65.2 11.4
165 4 7 0 31.686 63.372 0.341 5.12 4 40.1 4.3
166 2 4 4 31.7 63.4 0.341 5.11 8 171.4 156.2
167 6 1 2 31.764 63.528 0.342 5.09 8 29.0 4.4
168 4 6 2 31.799 63.598 0.342 5.08 8 136.2 98.0
169 0 8 2 31.827 63.654 0.342 5.07 4 112.1 33.1
170 5 2 3 31.924 63.849 0.343 5.03 8 62.0 20.1
171 3 7 2 31.983 63.966 0.344 5.01 8 223.6 260.6
172 3 3 4 32.092 64.184 0.345 4.97 8 156.5 126.7
173 6 4 0 32.109 64.219 0.345 4.97 4 24.5 1.6
174 1 8 2 32.225 64.451 0.346 4.93 8 79.3 32.3
175 0 7 3 32.254 64.507 0.346 4.92 4 110.6 31.3
176 5 6 0 32.299 64.599 0.347 4.91 4 28.0 2.0
177 3 8 0 32.327 64.654 0.347 4.9 4 44.4 5.0
178 6 2 2 32.449 64.898 0.348 4.86 8 78.0 30.7
179 4 7 1 32.457 64.913 0.348 4.85 8 27.9 3.9
180 1 5 4 32.561 65.122 0.349 4.82 8 124.7 78.0
181 1 7 3 32.649 65.298 0.35 4.79 8 11.0 0.6
182 4 0 4 32.818 65.636 0.352 4.74 4 30.6 2.3
183 3 6 3 32.861 65.723 0.352 4.73 8 81.0 32.3
184 5 5 2 32.864 65.728 0.352 4.73 8 168.7 140.0
185 6 4 1 32.875 65.749 0.352 4.72 8 12.4 0.8
186 1 9 0 33.02 66.039 0.354 4.68 4 112.5 30.8
187 4 1 4 33.043 66.087 0.354 4.67 8 16.1 1.3
188 5 3 3 33.059 66.118 0.354 4.67 8 73.8 26.5
189 5 6 1 33.062 66.125 0.354 4.67 8 17.9 1.6
190 3 8 1 33.09 66.18 0.354 4.66 8 99.4 47.8
191 4 5 3 33.131 66.261 0.355 4.65 8 75.1 27.3
192 0 9 1 33.386 66.771 0.357 4.57 4 175.0 72.8
193 2 8 2 33.405 66.811 0.357 4.56 8 86.6 35.6
194 6 3 2 33.574 67.149 0.359 4.52 8 18.8 1.7
195 0 1 5 33.599 67.198 0.359 4.51 4 12.9 0.4
196 3 4 4 33.671 67.342 0.36 4.49 8 64.2 19.3
197 4 2 4 33.715 67.429 0.36 4.48 8 72.2 24.3
198 2 5 4 33.735 67.47 0.36 4.47 8 77.8 28.2
199 1 9 1 33.774 67.549 0.361 4.46 8 3.0 0.0
200 2 7 3 33.822 67.643 0.361 4.45 8 68.6 21.8
201 7 1 0 33.832 67.665 0.361 4.44 4 1.2 0.0
202 1 1 5 33.986 67.973 0.363 4.4 8 60.5 16.8
203 6 5 0 34.132 68.263 0.364 4.36 4 98.8 22.1
204 2 9 0 34.186 68.371 0.365 4.35 4 99.7 22.5
205 7 2 0 34.496 68.992 0.368 4.27 4 27.9 1.7
206 7 1 1 34.578 69.157 0.368 4.25 8 39.6 6.9
207 5 4 3 34.615 69.23 0.369 4.24 8 58.9 15.3
208 0 6 4 34.627 69.253 0.369 4.24 4 52.8 6.1
209 1 2 5 34.649 69.297 0.369 4.23 8 32.1 4.5
210 4 7 2 34.715 69.43 0.37 4.21 8 31.6 4.4
211 4 3 4 34.82 69.639 0.371 4.19 8 44.9 8.8
212 6 5 1 34.875 69.749 0.371 4.17 8 65.7 18.8
213 2 0 5 34.918 69.836 0.372 4.16 4 22.3 1.1
214 2 9 1 34.928 69.856 0.372 4.16 8 64.1 17.8
215 1 6 4 35.009 70.018 0.372 4.14 8 29.7 3.8
216 4 8 0 35.045 70.09 0.373 4.13 4 99.0 21.1
217 6 4 2 35.119 70.239 0.373 4.12 8 147.3 92.9
218 2 1 5 35.137 70.273 0.374 4.11 8 27.8 3.3
219 5 7 0 35.194 70.388 0.374 4.1 4 31.0 2.0
220 7 2 1 35.236 70.471 0.374 4.09 8 150.7 96.7
221 5 6 2 35.302 70.603 0.375 4.07 8 12.6 0.7
222 6 0 3 35.308 70.617 0.375 4.07 4 9.0 0.2
223 3 8 2 35.328 70.656 0.375 4.07 8 65.1 17.9
224 0 3 5 35.362 70.723 0.376 4.06 4 4.7 0.0
225 6 1 3 35.526 71.052 0.377 4.02 8 112.8 53.2
226 4 6 3 35.559 71.118 0.377 4.02 8 57.4 13.8
227 7 3 0 35.59 71.179 0.378 4.01 4 3.3 0.0
228 3 5 4 35.649 71.299 0.378 4.0 8 104.2 45.2
229 3 7 3 35.734 71.467 0.379 3.98 8 100.3 41.6
230 1 3 5 35.74 71.48 0.379 3.98 8 13.2 0.7
231 4 8 1 35.78 71.559 0.38 3.97 8 24.0 2.4
232 2 2 5 35.789 71.579 0.38 3.96 8 18.2 1.4
233 5 7 1 35.927 71.854 0.381 3.93 8 34.4 4.8
234 1 8 3 35.963 71.927 0.381 3.93 8 101.1 41.8
235 1 9 2 35.993 71.985 0.381 3.92 8 4.5 0.1
236 3 9 0 36.089 72.178 0.382 3.9 4 93.6 17.8
237 2 6 4 36.145 72.289 0.383 3.89 8 99.7 40.2
238 6 2 3 36.176 72.352 0.383 3.88 8 54.4 12.0
239 7 3 1 36.319 72.639 0.384 3.85 8 11.1 0.5
240 4 4 4 36.341 72.681 0.385 3.85 8 77.5 24.0
241 5 1 4 36.487 72.974 0.386 3.82 8 127.2 64.3
242 6 6 0 36.529 73.059 0.386 3.81 4 112.5 25.1
243 5 5 3 36.571 73.141 0.387 3.8 8 68.4 18.5
244 7 1 2 36.775 73.55 0.389 3.76 8 145.6 83.0
245 0 10 0 36.803 73.606 0.389 3.76 2 50.0 2.4
246 3 9 1 36.815 73.629 0.389 3.75 8 51.6 10.4
247 2 3 5 36.867 73.733 0.389 3.75 8 58.3 13.2
248 3 1 5 37.019 74.038 0.391 3.72 8 28.9 3.2
249 6 5 2 37.064 74.127 0.391 3.71 8 66.9 17.2
250 2 8 3 37.087 74.174 0.391 3.7 8 23.2 2.1
251 7 4 0 37.098 74.195 0.392 3.7 4 14.5 0.4
252 2 9 2 37.116 74.232 0.392 3.7 8 48.8 9.2
253 5 2 4 37.13 74.26 0.392 3.7 8 102.1 40.1
254 1 10 0 37.176 74.352 0.392 3.69 4 14.4 0.4
255 1 4 5 37.246 74.491 0.393 3.67 8 7.6 0.2
256 6 3 3 37.249 74.497 0.393 3.67 8 10.7 0.4
257 6 6 1 37.252 74.504 0.393 3.67 8 48.7 9.1
258 7 2 2 37.416 74.832 0.394 3.64 8 22.1 1.9
259 3 2 5 37.659 75.317 0.397 3.6 8 64.6 15.6
260 1 7 4 37.808 75.616 0.398 3.58 8 103.4 39.8
261 7 4 1 37.816 75.632 0.398 3.57 8 32.8 4.0
262 1 10 1 37.894 75.787 0.399 3.56 8 19.0 1.3
263 4 8 2 37.948 75.895 0.399 3.55 8 42.8 6.8
264 3 6 4 38.007 76.014 0.4 3.54 8 6.7 0.2
265 5 7 2 38.092 76.184 0.4 3.53 8 55.9 11.5
266 5 3 4 38.193 76.386 0.401 3.51 8 43.3 6.8
267 4 5 4 38.26 76.521 0.402 3.5 8 31.3 3.6
268 2 10 0 38.286 76.573 0.402 3.5 4 70.6 9.1
269 4 7 3 38.343 76.685 0.403 3.49 8 7.7 0.2
270 2 4 5 38.355 76.711 0.403 3.49 8 37.9 5.2
271 5 8 0 38.411 76.822 0.403 3.48 4 9.3 0.2
272 7 3 2 38.476 76.952 0.404 3.47 8 110.7 44.2
273 4 9 0 38.689 77.378 0.406 3.44 4 61.6 6.8
274 3 3 5 38.717 77.433 0.406 3.43 8 24.7 2.2
275 6 4 3 38.732 77.465 0.406 3.43 8 9.0 0.3
276 0 5 5 38.784 77.567 0.407 3.42 4 78.2 10.9
277 5 6 3 38.908 77.816 0.408 3.4 8 21.2 1.6
278 2 7 4 38.912 77.825 0.408 3.4 8 29.8 3.2
279 3 8 3 38.933 77.867 0.408 3.4 8 126.5 56.6
280 3 9 2 38.962 77.924 0.408 3.4 8 63.4 14.2
281 2 10 1 38.997 77.995 0.408 3.39 8 7.0 0.2
282 7 5 0 39.004 78.009 0.409 3.39 4 95.6 16.1
283 5 8 1 39.121 78.242 0.41 3.37 8 53.4 10.0
284 1 5 5 39.15 78.3 0.41 3.37 8 52.9 9.8
285 0 9 3 39.211 78.421 0.41 3.36 4 199.1 69.3
286 8 0 0 39.243 78.486 0.411 3.36 2 74.5 4.8
287 6 7 0 39.288 78.575 0.411 3.35 4 29.4 1.5
288 4 0 5 39.388 78.777 0.412 3.33 4 70.5 8.6
289 6 6 2 39.391 78.782 0.412 3.33 8 16.0 0.9
290 4 9 1 39.398 78.796 0.412 3.33 8 41.3 5.9
291 8 1 0 39.453 78.905 0.412 3.33 4 23.5 1.0
292 1 9 3 39.576 79.152 0.414 3.31 8 28.0 2.7
293 4 1 5 39.598 79.195 0.414 3.31 8 41.3 5.9
294 0 10 2 39.658 79.316 0.414 3.3 4 51.6 4.6
295 5 4 4 39.665 79.331 0.414 3.3 8 65.4 14.7
296 7 5 1 39.712 79.423 0.415 3.29 8 3.1 0.0
297 7 4 2 39.946 79.891 0.417 3.26 8 7.5 0.2
298 8 0 1 39.949 79.898 0.417 3.26 4 42.0 3.0
299 6 7 1 39.994 79.987 0.417 3.26 8 3.5 0.0
300 1 10 2 40.022 80.044 0.417 3.25 8 5.9 0.1
301 8 2 0 40.08 80.16 0.418 3.24 4 106.2 19.0
302 3 10 0 40.115 80.231 0.418 3.24 4 29.5 1.5
303 8 1 1 40.158 80.315 0.419 3.24 8 10.0 0.3
304 3 4 5 40.184 80.367 0.419 3.23 8 55.3 10.3
305 4 2 5 40.224 80.449 0.419 3.23 8 37.5 4.7
306 2 5 5 40.244 80.487 0.419 3.22 8 38.1 4.9
307 6 0 4 40.327 80.653 0.42 3.21 4 72.7 8.8
308 7 1 3 40.335 80.669 0.42 3.21 8 22.4 1.7
309 6 1 4 40.535 81.07 0.422 3.19 8 26.6 2.3
310 4 6 4 40.567 81.133 0.422 3.19 8 3.9 0.1
311 0 8 4 40.592 81.184 0.422 3.18 4 33.5 1.9
312 6 5 3 40.616 81.231 0.423 3.18 8 73.5 17.9
313 2 9 3 40.666 81.333 0.423 3.18 8 71.3 16.8
314 3 7 4 40.734 81.467 0.424 3.17 8 63.7 13.4
315 8 2 1 40.782 81.565 0.424 3.16 8 41.1 5.6
316 3 10 1 40.818 81.635 0.424 3.16 8 2.2 0.0
317 1 8 4 40.954 81.908 0.425 3.14 8 69.2 15.6
318 7 2 3 40.959 81.918 0.426 3.14 8 144.6 68.4
319 2 10 2 41.11 82.22 0.427 3.13 8 50.5 8.3
320 8 3 0 41.12 82.241 0.427 3.13 4 47.6 3.7
321 6 2 4 41.158 82.316 0.427 3.12 8 54.9 9.8
322 5 8 2 41.232 82.465 0.428 3.11 8 20.7 1.4
323 4 3 5 41.264 82.528 0.428 3.11 8 79.0 20.2
324 7 6 0 41.3 82.599 0.428 3.11 4 17.1 0.5
325 0 0 6 41.311 82.622 0.429 3.11 2 236.3 45.1
326 1 6 5 41.443 82.887 0.43 3.09 8 52.3 8.8
327 4 8 3 41.478 82.956 0.43 3.09 8 39.8 5.1
328 4 9 2 41.506 83.011 0.43 3.09 8 36.2 4.2
329 5 5 4 41.538 83.077 0.43 3.08 8 25.1 2.0
330 1 11 0 41.583 83.165 0.431 3.08 4 27.2 1.2
331 5 7 3 41.619 83.238 0.431 3.07 8 25.4 2.1
332 7 5 2 41.816 83.632 0.433 3.06 8 27.9 2.5
333 8 3 1 41.819 83.638 0.433 3.06 8 35.8 4.1
334 1 1 6 41.879 83.758 0.433 3.05 8 21.6 1.5
335 0 11 1 41.92 83.84 0.434 3.05 4 72.2 8.3
336 5 9 0 41.959 83.917 0.434 3.04 4 27.1 1.2
337 7 3 3 41.995 83.99 0.434 3.04 8 32.5 3.3
338 7 6 1 41.998 83.996 0.434 3.04 8 29.8 2.8
339 2 8 4 42.037 84.074 0.435 3.03 8 45.3 6.5
340 8 0 2 42.051 84.101 0.435 3.03 4 52.7 4.4
341 3 5 5 42.052 84.103 0.435 3.03 8 48.4 7.4
342 6 7 2 42.095 84.19 0.435 3.03 8 40.4 5.1
343 0 2 6 42.139 84.278 0.436 3.03 4 66.5 7.0
344 6 3 4 42.193 84.387 0.436 3.02 8 22.4 1.6
345 8 1 2 42.257 84.515 0.437 3.02 8 33.4 3.5
346 1 11 1 42.28 84.561 0.437 3.01 8 38.0 4.5
347 6 8 0 42.406 84.813 0.438 3.0 4 70.8 7.8
348 3 9 3 42.471 84.942 0.438 3.0 8 60.9 11.6
349 1 2 6 42.499 84.998 0.439 2.99 8 11.1 0.4
350 2 6 5 42.524 85.048 0.439 2.99 8 14.2 0.6
351 8 4 0 42.569 85.137 0.439 2.99 4 15.2 0.4
352 4 10 0 42.644 85.288 0.44 2.98 4 182.8 51.8
353 5 9 1 42.655 85.311 0.44 2.98 8 33.9 3.6
354 2 11 0 42.663 85.326 0.44 2.98 4 20.4 0.6
355 4 4 5 42.712 85.423 0.44 2.98 8 24.9 1.9
356 2 0 6 42.752 85.504 0.441 2.97 4 132.7 27.2
357 5 1 5 42.852 85.704 0.441 2.97 8 15.1 0.7
358 8 2 2 42.876 85.753 0.442 2.96 8 7.9 0.2
359 6 6 3 42.893 85.785 0.442 2.96 8 75.8 17.7
360 3 10 2 42.911 85.823 0.442 2.96 8 17.8 1.0
361 2 1 6 42.958 85.916 0.442 2.96 8 25.0 1.9
362 6 8 1 43.102 86.204 0.444 2.95 8 18.6 1.1
363 4 7 4 43.256 86.513 0.445 2.93 8 26.8 2.2
364 8 4 1 43.264 86.528 0.445 2.93 8 4.4 0.1
365 4 10 1 43.339 86.679 0.446 2.93 8 45.9 6.4
366 2 11 1 43.358 86.717 0.446 2.93 8 17.4 0.9
367 7 4 3 43.439 86.878 0.446 2.92 8 45.0 6.2
368 5 2 5 43.47 86.941 0.447 2.92 8 9.2 0.3
369 1 10 3 43.514 87.029 0.447 2.92 8 10.2 0.3
370 1 3 6 43.529 87.059 0.447 2.92 8 132.1 52.9
371 2 2 6 43.576 87.152 0.447 2.91 8 91.1 25.1
372 6 4 4 43.637 87.273 0.448 2.91 8 12.3 0.5
373 0 7 5 43.767 87.534 0.449 2.9 4 66.0 6.6
374 5 6 4 43.808 87.617 0.449 2.9 8 15.1 0.7
375 3 8 4 43.834 87.667 0.45 2.89 8 54.5 9.0
376 8 3 2 43.906 87.812 0.45 2.89 8 61.8 11.5
377 7 7 0 43.983 87.966 0.451 2.89 4 213.3 68.3
378 7 6 2 44.084 88.168 0.452 2.88 8 17.5 0.9
379 1 7 5 44.125 88.251 0.452 2.88 8 12.7 0.5
380 3 6 5 44.319 88.637 0.454 2.87 8 48.0 6.9
381 1 11 2 44.365 88.73 0.454 2.86 8 87.3 22.7
382 8 5 0 44.422 88.844 0.454 2.86 4 46.9 3.3
383 3 11 0 44.457 88.914 0.455 2.86 4 73.0 7.9
384 1 9 4 44.463 88.926 0.455 2.86 8 103.6 31.9
385 5 3 5 44.499 88.998 0.455 2.85 8 40.9 5.0
386 4 5 5 44.565 89.129 0.455 2.85 8 25.7 2.0
387 2 10 3 44.59 89.18 0.456 2.85 8 16.4 0.8
388 2 3 6 44.605 89.21 0.456 2.85 8 70.9 14.9
389 0 4 6 44.611 89.222 0.456 2.85 4 149.4 33.1
390 7 7 1 44.677 89.353 0.456 2.85 8 30.4 2.7
391 5 8 3 44.711 89.422 0.457 2.84 8 40.6 4.9
392 5 9 2 44.739 89.478 0.457 2.84 8 92.9 25.5
393 3 1 6 44.751 89.502 0.457 2.84 8 107.6 34.2
394 1 4 6 44.969 89.939 0.459 2.83 8 39.2 4.5
395 4 9 3 44.982 89.964 0.459 2.83 8 55.5 9.1
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 1 1 0 5.693 11.387 7.76445 3504.0 100.0 100.0 5.6
2 0 2 0 6.881 13.763 6.429 223.2 6.4 6.4 5.6
3 1 1 1 8.519 17.039 5.19947 549.8 15.7 15.6 5.6
4 2 1 0 9.737 19.473 4.55469 54.2 1.5 1.5 5.6
5 1 2 1 10.42 20.841 4.25877 200.9 5.7 5.7 5.6
6 1 3 0 11.323 22.647 3.92305 91.4 2.6 2.6 5.6
7 2 1 1 11.64 23.28 3.81784 136.0 3.9 3.9 5.6
8 0 0 2 12.712 25.424 3.5005 1508.7 43.1 42.7 5.6
9 2 2 1 13.113 26.226 3.39516 73.8 2.1 2.1 5.6
10 2 3 0 13.851 27.702 3.21757 508.3 14.5 14.3 5.6
11 1 1 2 13.968 27.936 3.19118 254.5 7.3 7.2 5.6
12 0 2 2 14.51 29.02 3.07432 249.1 7.1 7.0 5.6
13 2 3 1 15.276 30.552 2.92359 213.4 6.1 6.0 5.6
14 3 2 0 15.413 30.825 2.89832 438.9 12.5 12.4 5.6
15 2 0 2 15.723 31.446 2.84251 399.5 11.4 11.2 5.6
16 2 4 0 16.685 33.37 2.68286 647.4 18.5 18.2 5.7
17 3 2 1 16.717 33.434 2.67791 216.4 6.2 6.1 5.7
18 1 3 2 17.152 34.305 2.61189 721.8 20.6 20.3 5.7
19 2 2 2 17.235 34.47 2.59974 374.5 10.7 10.5 5.7
20 3 3 0 17.315 34.629 2.58815 547.1 15.6 15.4 5.7
21 2 4 1 17.907 35.814 2.50521 36.4 1.0 1.0 5.7
22 1 5 0 18.047 36.094 2.48641 268.6 7.7 7.5 5.7
23 4 0 0 18.44 36.879 2.43525 53.9 1.5 1.5 5.7
24 0 5 1 18.609 37.217 2.41391 91.2 2.6 2.6 5.7
25 0 4 2 18.986 37.972 2.36766 441.7 12.6 12.4 5.7
26 3 1 2 19.212 38.425 2.34078 200.3 5.7 5.6 5.7
27 4 0 1 19.566 39.132 2.30007 110.8 3.2 3.1 5.7
28 3 4 0 19.706 39.412 2.2844 51.1 1.5 1.4 5.7
29 4 2 0 19.769 39.539 2.27734 63.1 1.8 1.8 5.7
30 2 5 0 19.799 39.598 2.27408 293.1 8.4 8.2 5.7
31 1 1 3 20.161 40.322 2.2349 496.5 14.2 13.9 5.7
32 3 4 1 20.774 41.549 2.17171 62.9 1.8 1.8 5.7
33 4 2 1 20.835 41.67 2.16565 102.1 2.9 2.8 5.7
34 1 2 3 21.096 42.193 2.14003 52.4 1.5 1.5 5.7
35 4 3 0 21.334 42.667 2.11734 89.1 2.5 2.5 5.7
36 2 0 3 21.469 42.939 2.10456 107.6 3.1 3.0 5.7
37 4 3 1 22.338 44.676 2.02668 150.7 4.3 4.2 5.7
38 3 5 0 22.464 44.927 2.01593 155.1 4.4 4.3 5.7
39 1 6 1 22.59 45.179 2.00526 73.5 2.1 2.0 5.7
40 4 0 2 22.663 45.327 1.99908 204.2 5.8 5.7 5.7
41 2 6 0 23.122 46.245 1.96152 131.5 3.8 3.6 5.7
42 4 4 0 23.38 46.76 1.94111 103.7 3.0 2.9 5.7
43 3 5 1 23.43 46.859 1.93722 74.3 2.1 2.1 5.7
44 5 1 0 23.571 47.143 1.92622 153.8 4.4 4.3 5.7
45 3 4 2 23.743 47.487 1.91307 84.6 2.4 2.3 5.7
46 2 5 2 23.824 47.647 1.907 163.3 4.7 4.5 5.7
47 2 3 3 24.064 48.127 1.8891 112.0 3.2 3.1 5.7
48 5 2 0 24.402 48.804 1.86447 94.8 2.7 2.6 5.7
49 0 6 2 24.926 49.852 1.8277 44.5 1.3 1.2 5.7
50 3 2 3 25.073 50.146 1.81769 47.9 1.4 1.3 5.7
51 1 7 0 25.261 50.521 1.80505 89.9 2.6 2.5 5.8
52 0 7 1 25.692 51.385 1.77672 37.5 1.1 1.0 5.8
53 2 4 3 25.943 51.885 1.76076 69.1 2.0 1.9 5.8
54 0 0 4 26.11 52.22 1.75025 379.5 10.8 10.5 5.8
55 3 6 1 26.391 52.783 1.73292 42.9 1.2 1.2 5.8
56 0 5 3 26.47 52.939 1.72816 114.9 3.3 3.2 5.8
57 5 3 1 26.617 53.235 1.71926 51.9 1.5 1.4 5.8
58 1 1 4 26.817 53.634 1.70741 73.1 2.1 2.0 5.8
59 1 5 3 26.916 53.832 1.70159 58.0 1.7 1.6 5.8
60 4 0 3 27.204 54.408 1.68492 63.3 1.8 1.7 5.8
61 2 7 1 27.483 54.966 1.66913 77.1 2.2 2.1 5.8
62 5 2 2 27.91 55.82 1.6456 119.8 3.4 3.3 5.8
63 3 4 3 28.155 56.309 1.63245 108.2 3.1 3.0 5.8
64 1 8 0 29.061 58.121 1.58581 60.8 1.7 1.7 5.8
65 5 3 2 29.135 58.271 1.58209 71.0 2.0 1.9 5.8
66 6 1 1 29.388 58.775 1.5697 136.2 3.9 3.7 5.8
67 4 3 3 29.421 58.841 1.5681 61.1 1.7 1.7 5.8
68 3 7 1 29.617 59.234 1.55864 82.4 2.4 2.2 5.8
69 2 3 4 30.066 60.132 1.5375 39.7 1.1 1.1 5.8
70 3 5 3 30.326 60.652 1.52554 51.7 1.5 1.4 5.8
71 5 5 1 30.536 61.073 1.51604 51.5 1.5 1.4 5.8
72 5 4 2 30.799 61.597 1.50438 38.7 1.1 1.1 5.8
73 3 2 4 30.939 61.877 1.49825 54.6 1.6 1.5 5.8
74 2 4 4 31.7 63.4 1.46589 160.5 4.6 4.3 5.9
75 4 6 2 31.799 63.598 1.4618 131.1 3.7 3.6 5.9
76 3 7 2 31.983 63.966 1.45426 260.6 7.4 7.1 5.9
77 3 3 4 32.092 64.184 1.44985 128.3 3.7 3.5 5.9
78 1 8 2 32.225 64.451 1.44449 63.6 1.8 1.7 5.9
79 1 5 4 32.561 65.122 1.43122 78.0 2.2 2.1 5.9
80 5 5 2 32.864 65.728 1.41948 173.0 4.9 4.7 5.9
81 3 8 1 33.09 66.18 1.41089 47.8 1.4 1.3 5.9
82 0 9 1 33.386 66.771 1.39982 108.4 3.1 2.9 5.9
83 2 5 4 33.735 67.47 1.38701 52.4 1.5 1.4 5.9
84 6 4 2 35.119 70.239 1.33896 96.2 2.7 2.6 5.9
85 7 2 1 35.236 70.471 1.33511 96.7 2.8 2.6 5.9
86 6 1 3 35.526 71.052 1.32562 53.2 1.5 1.4 5.9
87 3 5 4 35.649 71.299 1.32164 45.2 1.3 1.2 5.9
88 3 7 3 35.734 71.467 1.31893 42.3 1.2 1.1 5.9
89 1 8 3 35.963 71.927 1.31163 41.8 1.2 1.1 5.9
90 2 6 4 36.145 72.289 1.30594 40.2 1.1 1.1 5.9
91 5 1 4 36.487 72.974 1.29537 64.3 1.8 1.7 6.0
92 7 1 2 36.775 73.55 1.28665 85.4 2.4 2.3 6.0
93 5 2 4 37.13 74.26 1.27608 49.3 1.4 1.3 6.0
94 1 7 4 37.808 75.616 1.25654 43.8 1.2 1.2 6.0
95 7 3 2 38.476 76.952 1.23802 44.2 1.3 1.2 6.0
96 3 8 3 38.933 77.867 1.22574 75.5 2.2 2.0 6.0
97 0 9 3 39.211 78.421 1.21847 69.3 2.0 1.8 6.0
98 7 2 3 40.959 81.918 1.17507 84.0 2.4 2.2 6.1
99 0 0 6 41.311 82.622 1.16683 45.1 1.3 1.2 6.1
100 4 10 0 42.644 85.288 1.13704 56.1 1.6 1.5 6.1
101 1 3 6 43.529 87.059 1.11841 52.9 1.5 1.4 6.1
102 7 7 0 43.983 87.966 1.10921 68.3 1.9 1.8 6.2
103 1 9 4 44.463 88.926 1.09969 39.8 1.1 1.0 6.2
104 0 4 6 44.611 89.222 1.09681 48.0 1.4 1.2 6.2
105 3 1 6 44.751 89.502 1.0941 64.6 1.8 1.7 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)
|