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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SILICOCARNOTITE
2, t-ternesite, s-ternesite, DF
Ca(5)[SiO(4)PO(4)]PO(4)
Orthorhombic P nma Z = 4
R =0.015 NR =1519
11 .2 .25
Ref.Str.:
Galuskin E.V., Galuskina I.O., Ksiazek M., Kusz J.,
Vapnik Y., Zielinski G. (2024)
* Minerals, 14, 1301, doi.org/10.3390/min14121301
L: Ca4.98 Mn2+0.01 Na0.1 Si1.9 P1.77 V5+0.2 S6+0.03 O12$
R: Locality - the Hatrurim Complex, Negev Deser, Israel.
IMA2013-139. N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 6.7297 alpha = 90.0
b = 15.5109 beta = 90.0
c = 10.1147 gamma = 90.0
Unit cell volume (cub. angs.) = 1055.81
Molar volume ( cub.cm/mol.) = 158.99
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0437 0.25 0.187 0.0 Ca = 0.87, Ca = 0.0
2 0.0237 0.25 0.1548 0.0 Ca = 0.14, Ca = 0.0
3 0.1684 0.8939 0.1649 0.0 Ca = 1.00
4 0.3681 0.0919 0.0648 0.0 Ca = 1.00
5 0.3514 0.0722 0.369 0.0 Si = 0.5 , P = 0.45, V = 0.05
6 0.0267 0.25 0.5784 0.0 P = 0.9 , V = 0.1
7 0.2571 0.25 0.5791 0.0 O = 1.00
8 0.9332 0.25 0.4363 0.0 O = 1.00
9 0.9575 0.1654 0.6473 0.0 O = 1.00
10 0.4085 0.9942 0.2735 0.0 O = 1.00
11 0.1875 0.0439 0.4743 0.0 O = 1.00
12 0.2747 0.1491 0.2768 0.0 O = 1.00
13 0.5301 0.1109 0.4547 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0437 0.25 0.187
2 2 0.0237 0.25 0.1548
3 3 0.1684 0.8939 0.1649
4 4 0.3681 0.0919 0.0648
5 5 0.3514 0.0722 0.369
6 6 0.0267 0.25 0.5784
7 7 0.2571 0.25 0.5791
8 8 0.9332 0.25 0.4363
9 9 0.9575 0.1654 0.6473
10 10 0.4085 0.9942 0.2735
11 11 0.1875 0.0439 0.4743
12 12 0.2747 0.1491 0.2768
13 13 0.5301 0.1109 0.4547
14 1 0.4563 0.75 0.687
15 2 0.4763 0.75 0.6548
16 3 0.3316 0.1061 0.6649
17 4 0.1319 0.9081 0.5648
18 5 0.1486 0.9278 0.869
19 6 0.4733 0.75 0.0784
20 7 0.2429 0.75 0.0791
21 8 0.5668 0.75 0.9363
22 9 0.5425 0.8346 0.1473
23 10 0.0915 0.0058 0.7735
24 11 0.3125 0.9561 0.9743
25 12 0.2253 0.8509 0.7768
26 13 0.9699 0.8891 0.9547
27 3 0.3316 0.3939 0.6649
28 4 0.1319 0.5919 0.5648
29 5 0.1486 0.5722 0.869
30 9 0.5425 0.6654 0.1473
31 10 0.0915 0.4942 0.7735
32 11 0.3125 0.5439 0.9743
33 12 0.2253 0.6491 0.7768
34 13 0.9699 0.6109 0.9547
35 3 0.1684 0.6061 0.1649
36 4 0.3681 0.4081 0.0648
37 5 0.3514 0.4278 0.369
38 9 0.9575 0.3346 0.6473
39 10 0.4085 0.5058 0.2735
40 11 0.1875 0.4561 0.4743
41 12 0.2747 0.3509 0.2768
42 13 0.5301 0.3891 0.4547
43 1 0.5437 0.25 0.313
44 2 0.5237 0.25 0.3452
45 3 0.6684 0.8939 0.3351
46 4 0.8681 0.0919 0.4352
47 5 0.8514 0.0722 0.131
48 6 0.5267 0.25 0.9216
49 7 0.7571 0.25 0.9209
50 8 0.4332 0.25 0.0637
51 9 0.4575 0.1654 0.8527
52 10 0.9085 0.9942 0.2265
53 11 0.6875 0.0439 0.0257
54 12 0.7747 0.1491 0.2232
55 13 0.0301 0.1109 0.0453
56 1 0.9563 0.75 0.813
57 2 0.9763 0.75 0.8452
58 3 0.8316 0.1061 0.8351
59 4 0.6319 0.9081 0.9352
60 5 0.6486 0.9278 0.631
61 6 0.9733 0.75 0.4216
62 7 0.7429 0.75 0.4209
63 8 0.0668 0.75 0.5637
64 9 0.0425 0.8346 0.3527
65 10 0.5915 0.0058 0.7265
66 11 0.8125 0.9561 0.5257
67 12 0.7253 0.8509 0.7232
68 13 0.4699 0.8891 0.5453
69 3 0.8316 0.3939 0.8351
70 4 0.6319 0.5919 0.9352
71 5 0.6486 0.5722 0.631
72 9 0.0425 0.6654 0.3527
73 10 0.5915 0.4942 0.7265
74 11 0.8125 0.5439 0.5257
75 12 0.7253 0.6491 0.7232
76 13 0.4699 0.6109 0.5453
77 3 0.6684 0.6061 0.3351
78 4 0.8681 0.4081 0.4352
79 5 0.8514 0.4278 0.131
80 9 0.4575 0.3346 0.8527
81 10 0.9085 0.5058 0.2265
82 11 0.6875 0.4561 0.0257
83 12 0.7747 0.3509 0.2232
84 13 0.0301 0.3891 0.0453
X-ray density (g/cm cub.) = 3.06
MU (1/cm) = 269.672 Mass attenuation coefficient (cm**2/g) = 88.155
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca ,Ca 2.88 7
2.6293 8
2.3856 12
2.3855 12
2.4206 12
2.5921 13
2.4206 12
2.5921 13
2 Ca ,Ca 2.88 6
2.6125 12
2.6125 12
2.3948 12
2.4259 13
2.3948 12
2.4259 13
3 Ca 2.88 7
2.4981 10
2.446 7
2.6859 9
2.3638 11
2.5118 13
2.4227 10
2.274 9
4 Ca 2.88 7
2.6127 10
2.4035 12
2.3282 11
2.4907 8
2.5027 9
2.3091 11
2.3018 13
5 Si ,P ,V 2.496 4
1.5958 10
1.5947 11
1.5996 12
1.599 13
6 P ,V 2.496 4
1.5507 7
1.5684 8
1.5576 9
1.5576 9
7 O 3.264 5
2.6148 8
2.5029 9
3.1008 13
2.5029 9
3.1008 13
8 O 3.264 7
2.6148 7
2.5107 9
3.215 12
2.5107 9
3.215 12
2.8691 12
2.8691 12
9 O 3.264 5
2.5029 7
2.5107 8
3.0011 11
2.9271 10
2.6254 9
10 O 3.264 7
2.6328 11
2.5662 12
2.7029 13
2.9271 9
3.1507 11
3.2251 11
3.2226 13
11 O 3.264 8
3.0011 9
2.6328 10
2.6451 12
2.5364 13
3.1507 10
3.2251 10
2.9154 11
3.1454 13
12 O 3.264 7
3.215 8
2.5662 10
2.6451 11
2.5583 13
3.1298 12
2.8691 8
2.923 13
13 O 3.264 7
3.1008 7
2.7029 10
2.5364 11
2.5583 12
2.923 12
3.2226 10
3.1454 11
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 0 1 1 5.216 10.433 0.059 238.99 4 45.2 174.9
2 0 2 0 5.7 11.4 0.064 199.77 2 46.0 75.9
3 1 0 1 7.902 15.804 0.089 102.87 4 46.5 79.8
4 1 1 1 8.405 16.81 0.095 90.66 8 35.0 79.9
5 0 0 2 8.761 17.522 0.099 83.28 2 19.0 5.4
6 0 3 1 9.632 19.264 0.109 68.52 4 16.0 6.3
7 1 2 1 9.765 19.529 0.11 66.61 8 55.2 145.8
8 0 2 2 10.476 20.953 0.118 57.58 4 21.9 9.9
9 1 0 2 10.983 21.967 0.124 52.2 4 95.9 172.2
10 1 1 2 11.355 22.71 0.128 48.7 8 88.3 272.7
11 0 4 0 11.458 22.915 0.129 47.8 2 106.1 96.5
12 1 3 1 11.696 23.392 0.132 45.78 8 32.8 35.4
13 1 2 2 12.407 24.814 0.139 40.45 8 53.8 84.2
14 2 0 0 13.233 26.467 0.149 35.31 2 17.0 1.8
15 0 1 3 13.521 27.042 0.152 33.74 4 0.1 0.0
16 2 1 0 13.547 27.094 0.152 33.6 4 162.2 317.2
17 2 0 1 13.961 27.921 0.157 31.53 4 36.4 15.0
18 1 4 1 13.98 27.959 0.157 31.43 8 55.0 68.3
19 1 3 2 13.996 27.992 0.157 31.36 8 106.2 254.0
20 2 1 1 14.259 28.519 0.16 30.14 8 8.4 1.5
21 2 2 0 14.45 28.9 0.162 29.29 4 136.4 195.4
22 0 4 2 14.496 28.992 0.162 29.1 4 5.7 0.3
23 1 0 3 14.805 29.61 0.166 27.81 4 162.7 264.1
24 0 5 1 15.053 30.107 0.169 26.84 4 95.8 88.4
25 1 1 3 15.089 30.177 0.169 26.71 8 96.1 177.1
26 2 2 1 15.123 30.247 0.169 26.57 8 95.7 174.8
27 0 3 3 15.828 31.656 0.177 24.1 4 268.8 624.7
28 2 3 0 15.851 31.701 0.177 24.02 4 283.3 691.9
29 1 2 3 15.912 31.823 0.178 23.82 8 29.2 14.6
30 2 0 2 15.96 31.919 0.178 23.67 4 31.4 8.4
31 1 4 2 15.976 31.953 0.179 23.62 8 64.2 69.9
32 2 1 2 16.225 32.45 0.181 22.84 8 3.3 0.2
33 2 3 1 16.472 32.944 0.184 22.1 8 28.4 12.8
34 1 5 1 16.488 32.977 0.184 22.06 8 61.7 60.2
35 2 2 2 16.999 33.997 0.19 20.64 8 28.4 12.0
36 1 3 3 17.205 34.41 0.192 20.11 8 172.7 430.6
37 0 6 0 17.335 34.671 0.193 19.78 2 318.9 360.8
38 2 4 0 17.643 35.286 0.197 19.03 4 132.6 120.1
39 0 0 4 17.735 35.47 0.198 18.82 2 97.3 32.0
40 2 4 1 18.211 36.421 0.203 17.76 8 58.1 43.0
41 2 3 2 18.224 36.447 0.203 17.73 8 29.2 10.9
42 1 5 2 18.239 36.477 0.203 17.7 8 41.4 21.8
43 0 2 4 18.687 37.374 0.208 16.78 4 43.1 11.2
44 2 0 3 18.87 37.74 0.21 16.42 4 107.9 68.6
45 1 4 3 18.884 37.769 0.21 16.39 8 52.9 33.0
46 1 0 4 18.991 37.981 0.211 16.19 4 61.0 21.6
47 2 1 3 19.099 38.199 0.212 15.99 8 3.9 0.2
48 1 6 1 19.157 38.313 0.213 15.88 8 12.3 1.7
49 1 1 4 19.219 38.438 0.214 15.77 8 50.1 28.4
50 0 6 2 19.55 39.101 0.217 15.18 4 152.0 125.9
51 0 5 3 19.72 39.439 0.219 14.9 4 72.3 27.9
52 2 5 0 19.738 39.477 0.219 14.86 4 18.7 1.9
53 2 2 3 19.775 39.55 0.22 14.8 8 6.3 0.4
54 2 4 2 19.829 39.657 0.22 14.71 8 119.2 149.9
55 1 2 4 19.891 39.782 0.221 14.61 8 17.4 3.2
56 2 5 1 20.255 40.511 0.225 14.03 8 70.6 50.1
57 3 0 1 20.593 41.185 0.228 13.53 4 1.2 0.0
58 1 6 2 20.712 41.424 0.23 13.35 8 121.7 141.9
59 3 1 1 20.806 41.613 0.231 13.22 8 99.3 93.5
60 0 7 1 20.847 41.693 0.231 13.16 4 2.0 0.0
61 2 3 3 20.86 41.72 0.231 13.14 8 26.1 6.4
62 1 5 3 20.873 41.746 0.231 13.12 8 32.8 10.1
63 1 3 4 20.971 41.942 0.232 12.99 8 18.7 3.3
64 0 4 4 21.325 42.651 0.236 12.51 4 68.8 21.3
65 3 2 1 21.437 42.874 0.237 12.36 8 57.4 29.3
66 2 5 2 21.745 43.491 0.24 11.97 8 45.5 17.8
67 1 7 1 21.952 43.903 0.243 11.72 8 34.1 9.8
68 3 0 2 22.064 44.128 0.244 11.59 4 48.9 10.0
69 2 6 0 22.071 44.141 0.244 11.58 4 9.0 0.3
70 3 1 2 22.266 44.532 0.246 11.35 8 149.3 181.6
71 2 4 3 22.306 44.612 0.246 11.31 8 57.7 27.0
72 2 0 4 22.399 44.797 0.247 11.2 4 11.4 0.5
73 1 4 4 22.411 44.822 0.247 11.19 8 6.4 0.3
74 3 3 1 22.456 44.912 0.248 11.14 8 43.2 14.9
75 2 6 1 22.544 45.087 0.249 11.04 8 4.9 0.2
76 0 1 5 22.582 45.163 0.249 11.0 4 123.7 60.4
77 2 1 4 22.598 45.197 0.249 10.98 8 77.8 47.7
78 3 2 2 22.864 45.729 0.252 10.69 8 33.3 8.5
79 1 6 3 23.112 46.224 0.255 10.43 8 154.6 179.0
80 2 2 4 23.19 46.38 0.256 10.36 8 52.8 20.7
81 1 7 2 23.354 46.708 0.257 10.19 8 30.2 6.7
82 0 8 0 23.409 46.817 0.258 10.14 2 154.2 43.2
83 1 0 5 23.428 46.857 0.258 10.12 4 132.5 63.7
84 1 1 5 23.622 47.243 0.26 9.93 8 29.4 6.2
85 3 4 1 23.825 47.649 0.262 9.74 8 18.3 2.3
86 3 3 2 23.835 47.67 0.262 9.73 8 40.0 11.2
87 2 6 2 23.919 47.838 0.263 9.65 8 11.8 1.0
88 2 5 3 24.063 48.126 0.265 9.52 8 72.2 35.6
89 0 3 5 24.135 48.269 0.265 9.46 4 216.1 158.5
90 2 3 4 24.151 48.301 0.266 9.44 8 145.6 143.7
91 1 5 4 24.162 48.325 0.266 9.43 8 56.3 21.5
92 1 2 5 24.194 48.387 0.266 9.41 8 64.0 27.7
93 3 0 3 24.358 48.716 0.268 9.26 4 231.2 177.7
94 3 1 3 24.546 49.091 0.27 9.1 8 31.7 6.6
95 0 7 3 24.581 49.162 0.27 9.07 4 41.0 5.5
96 2 7 0 24.597 49.193 0.27 9.06 4 148.2 71.4
97 1 8 1 24.86 49.72 0.273 8.84 8 13.7 1.2
98 2 7 1 25.033 50.066 0.275 8.7 8 124.5 96.8
99 3 2 3 25.102 50.204 0.275 8.65 8 124.8 96.7
100 1 3 5 25.125 50.251 0.276 8.63 8 87.1 47.0
101 3 4 2 25.146 50.293 0.276 8.62 8 3.4 0.1
102 0 8 2 25.181 50.362 0.276 8.59 4 57.1 10.0
103 0 6 4 25.221 50.443 0.277 8.56 4 147.3 66.6
104 2 4 4 25.449 50.899 0.279 8.38 8 17.9 1.9
105 3 5 1 25.502 51.003 0.279 8.34 8 18.5 2.1
106 1 7 3 25.559 51.118 0.28 8.3 8 133.9 106.8
107 3 3 3 26.01 52.019 0.285 7.98 8 75.1 32.3
108 2 6 3 26.088 52.176 0.285 7.92 8 193.0 211.9
109 1 8 2 26.143 52.285 0.286 7.89 8 128.6 93.6
110 1 6 4 26.182 52.364 0.286 7.86 8 15.6 1.4
111 2 7 2 26.31 52.619 0.288 7.77 8 41.7 9.7
112 2 0 5 26.378 52.756 0.288 7.73 4 153.2 65.1
113 1 4 5 26.389 52.778 0.289 7.72 8 45.9 11.7
114 2 1 5 26.555 53.11 0.29 7.61 8 24.6 3.3
115 3 5 2 26.762 53.525 0.292 7.48 8 12.5 0.8
116 0 9 1 26.961 53.922 0.294 7.35 4 10.3 0.3
117 0 5 5 27.038 54.076 0.295 7.3 4 126.4 41.9
118 2 5 4 27.053 54.105 0.295 7.29 8 56.1 16.5
119 2 2 5 27.081 54.163 0.296 7.28 8 15.9 1.3
120 0 0 6 27.189 54.378 0.297 7.21 2 9.3 0.1
121 3 4 3 27.244 54.488 0.297 7.18 8 174.9 157.7
122 4 0 0 27.248 54.496 0.297 7.18 2 86.3 9.6
123 2 8 0 27.292 54.583 0.298 7.15 4 88.9 20.3
124 3 0 4 27.324 54.648 0.298 7.13 4 86.6 19.2
125 4 1 0 27.421 54.842 0.299 7.07 4 127.7 41.4
126 3 6 1 27.45 54.899 0.299 7.06 8 4.2 0.1
127 3 1 4 27.497 54.994 0.3 7.03 8 8.8 0.4
128 4 0 1 27.654 55.308 0.301 6.94 4 0.6 0.0
129 2 8 1 27.697 55.395 0.302 6.91 8 63.3 19.9
130 4 1 1 27.825 55.651 0.303 6.84 8 0.8 0.0
131 0 2 6 27.878 55.757 0.304 6.81 4 19.4 0.9
132 1 9 1 27.879 55.759 0.304 6.81 8 44.6 9.7
133 4 2 0 27.936 55.872 0.304 6.78 4 185.9 84.0
134 2 3 5 27.944 55.887 0.304 6.78 8 1.9 0.0
135 1 5 5 27.954 55.909 0.304 6.77 8 55.4 14.9
136 3 2 4 28.011 56.022 0.305 6.74 8 67.9 22.3
137 1 0 6 28.102 56.204 0.306 6.69 4 57.0 7.8
138 1 8 3 28.188 56.376 0.307 6.64 8 50.6 12.2
139 1 1 6 28.272 56.544 0.307 6.6 8 15.0 1.1
140 4 2 1 28.336 56.672 0.308 6.57 8 58.6 16.2
141 2 7 3 28.347 56.694 0.308 6.56 8 4.7 0.1
142 1 7 4 28.435 56.871 0.309 6.51 8 9.2 0.4
143 3 6 2 28.651 57.301 0.311 6.4 8 81.5 30.6
144 1 2 6 28.777 57.554 0.312 6.34 8 7.6 0.3
145 3 5 3 28.778 57.556 0.312 6.34 8 31.3 4.4
146 4 3 0 28.781 57.563 0.313 6.34 4 84.2 16.1
147 4 0 2 28.849 57.699 0.313 6.3 4 19.0 0.8
148 3 3 4 28.855 57.71 0.313 6.3 8 52.4 12.4
149 2 8 2 28.892 57.783 0.314 6.28 8 37.2 6.2
150 2 6 4 28.928 57.856 0.314 6.27 8 59.7 16.0
151 4 1 2 29.016 58.032 0.315 6.22 8 48.2 10.4
152 1 9 2 29.069 58.138 0.315 6.2 8 69.8 21.7
153 2 4 5 29.122 58.244 0.316 6.17 8 68.1 20.5
154 4 3 1 29.173 58.347 0.316 6.15 8 27.9 3.4
155 4 2 2 29.513 59.027 0.32 5.99 8 6.2 0.2
156 1 3 6 29.607 59.213 0.321 5.95 8 80.1 27.4
157 3 7 1 29.638 59.276 0.321 5.93 8 57.5 14.1
158 0 10 0 29.776 59.551 0.322 5.87 2 17.0 0.3
159 1 6 5 29.793 59.585 0.323 5.86 8 67.6 19.2
160 0 4 6 29.883 59.767 0.323 5.82 4 72.0 10.8
161 4 4 0 29.939 59.878 0.324 5.8 4 109.0 24.7
162 3 4 4 30.011 60.021 0.325 5.77 8 41.6 7.2
163 0 8 4 30.041 60.083 0.325 5.76 4 45.5 4.3
164 0 9 3 30.129 60.258 0.326 5.72 4 166.9 57.2
165 2 9 0 30.143 60.286 0.326 5.71 4 191.2 74.9
166 4 4 1 30.321 60.643 0.328 5.64 8 13.5 0.7
167 4 3 2 30.33 60.661 0.328 5.63 8 18.5 1.4
168 2 9 1 30.524 61.048 0.33 5.55 8 3.0 0.0
169 3 6 3 30.585 61.169 0.33 5.53 8 78.1 24.2
170 2 5 5 30.595 61.19 0.33 5.53 8 33.1 4.3
171 2 0 6 30.735 61.469 0.332 5.47 4 31.2 1.9
172 1 4 6 30.745 61.49 0.332 5.47 8 32.9 4.2
173 4 0 3 30.776 61.551 0.332 5.45 4 0.6 0.0
174 3 7 2 30.784 61.569 0.332 5.45 8 156.6 95.9
175 2 8 3 30.816 61.632 0.333 5.44 8 41.7 6.8
176 3 0 5 30.846 61.692 0.333 5.43 4 27.8 1.5
177 2 1 6 30.895 61.791 0.333 5.41 8 6.3 0.2
178 1 8 4 30.9 61.8 0.333 5.41 8 11.3 0.5
179 4 1 3 30.936 61.872 0.334 5.39 8 121.7 57.4
180 1 9 3 30.987 61.973 0.334 5.37 8 92.9 33.3
181 3 1 5 31.006 62.013 0.334 5.36 8 34.3 4.5
182 1 10 1 31.016 62.033 0.334 5.36 8 36.8 5.2
183 0 7 5 31.037 62.073 0.335 5.35 4 86.8 14.5
184 2 7 4 31.05 62.1 0.335 5.35 8 17.2 1.1
185 0 10 2 31.295 62.589 0.337 5.26 4 5.7 0.1
186 2 2 6 31.374 62.748 0.338 5.23 8 46.4 8.1
187 4 5 0 31.388 62.777 0.338 5.22 4 39.9 3.0
188 4 2 3 31.415 62.829 0.338 5.21 8 81.0 24.5
189 4 4 2 31.453 62.906 0.339 5.2 8 52.3 10.2
190 3 5 4 31.458 62.917 0.339 5.2 8 45.0 7.6
191 3 2 5 31.484 62.969 0.339 5.19 8 37.3 5.2
192 2 9 2 31.651 63.303 0.341 5.13 8 34.3 4.3
193 4 5 1 31.761 63.522 0.342 5.09 8 59.2 12.8
194 1 7 5 31.88 63.76 0.343 5.05 8 12.0 0.5
195 3 8 1 32.046 64.093 0.344 4.99 8 8.1 0.2
196 1 10 2 32.134 64.268 0.345 4.96 8 103.7 38.3
197 2 3 6 32.163 64.327 0.346 4.95 8 23.1 1.9
198 1 5 6 32.173 64.347 0.346 4.95 8 28.6 2.9
199 4 3 3 32.203 64.406 0.346 4.94 8 60.2 12.9
200 3 3 5 32.272 64.544 0.347 4.91 8 17.0 1.0
201 2 6 5 32.341 64.681 0.347 4.89 8 51.4 9.3
202 0 1 7 32.37 64.741 0.348 4.88 4 23.5 1.0
203 3 7 3 32.642 65.285 0.35 4.8 8 11.3 0.4
204 4 5 2 32.864 65.728 0.352 4.73 8 39.5 5.3
205 1 0 7 33.04 66.081 0.354 4.67 4 84.8 12.1
206 0 6 6 33.058 66.117 0.354 4.67 4 11.3 0.2
207 4 6 0 33.111 66.221 0.355 4.65 4 99.4 16.5
208 3 8 2 33.145 66.29 0.355 4.64 8 56.4 10.6
209 2 10 0 33.15 66.299 0.355 4.64 4 49.3 4.0
210 3 6 4 33.179 66.357 0.355 4.63 8 35.7 4.2
211 1 1 7 33.195 66.39 0.355 4.63 8 48.2 7.7
212 2 4 6 33.251 66.502 0.356 4.61 8 10.0 0.3
213 4 4 3 33.29 66.581 0.356 4.6 8 55.1 10.0
214 3 4 5 33.358 66.716 0.357 4.58 8 106.9 37.6
215 4 0 4 33.361 66.723 0.357 4.58 4 60.6 6.0
216 2 8 4 33.4 66.8 0.357 4.57 8 13.5 0.6
217 4 6 1 33.473 66.946 0.358 4.55 8 5.6 0.1
218 0 11 1 33.473 66.947 0.358 4.55 4 134.3 29.4
219 2 9 3 33.483 66.966 0.358 4.54 8 10.7 0.4
220 2 10 1 33.512 67.023 0.358 4.53 8 4.4 0.1
221 4 1 4 33.515 67.03 0.358 4.53 8 26.3 2.3
222 1 9 4 33.563 67.127 0.359 4.52 8 21.6 1.5
223 0 3 7 33.608 67.216 0.359 4.51 4 91.8 13.6
224 1 2 7 33.656 67.312 0.36 4.49 8 1.7 0.0
225 1 6 6 33.874 67.749 0.362 4.43 8 121.4 46.9
226 1 10 3 33.952 67.903 0.363 4.41 8 3.6 0.0
227 4 2 4 33.974 67.948 0.363 4.41 8 46.6 6.9
228 1 8 5 34.199 68.398 0.365 4.35 8 114.7 41.0
229 1 11 1 34.284 68.569 0.366 4.32 8 15.7 0.8
230 2 7 5 34.341 68.683 0.366 4.31 8 41.3 5.3
231 1 3 7 34.417 68.835 0.367 4.29 8 155.2 74.1
232 4 6 2 34.548 69.096 0.368 4.26 8 19.4 1.2
233 2 10 2 34.586 69.172 0.368 4.25 8 24.9 1.9
234 2 5 6 34.624 69.248 0.369 4.24 8 45.0 6.2
235 4 5 3 34.662 69.325 0.369 4.23 8 76.9 17.9
236 3 9 1 34.663 69.325 0.369 4.23 8 1.7 0.0
237 3 5 5 34.729 69.458 0.37 4.21 8 18.6 1.0
238 4 3 4 34.732 69.464 0.37 4.21 8 64.1 12.4
239 3 0 6 34.86 69.719 0.371 4.18 4 116.7 20.4
240 3 8 3 34.936 69.872 0.372 4.16 8 33.4 3.3
241 3 1 6 35.01 70.02 0.372 4.14 8 65.3 12.7
242 4 7 0 35.09 70.179 0.373 4.12 4 186.2 51.3
243 3 7 4 35.156 70.311 0.374 4.11 8 8.5 0.2
244 5 0 1 35.264 70.528 0.375 4.08 4 43.1 2.7
245 1 11 2 35.348 70.696 0.376 4.06 8 132.4 51.1
246 5 1 1 35.414 70.827 0.376 4.05 8 25.3 1.9
247 4 7 1 35.442 70.884 0.376 4.04 8 9.7 0.3
248 3 2 6 35.46 70.92 0.377 4.04 8 23.0 1.5
249 2 0 7 35.461 70.923 0.377 4.04 4 127.6 23.6
250 1 4 7 35.471 70.942 0.377 4.04 8 25.1 1.8
251 2 1 7 35.611 71.222 0.378 4.0 8 78.5 17.7
252 0 10 4 35.633 71.266 0.378 4.0 4 9.9 0.1
253 3 9 2 35.721 71.442 0.379 3.98 8 34.6 3.4
254 4 4 4 35.781 71.563 0.38 3.97 8 83.1 19.6
255 1 7 6 35.833 71.666 0.38 3.96 8 42.6 5.1
256 5 2 1 35.861 71.723 0.38 3.95 8 6.8 0.1
257 0 9 5 35.955 71.91 0.381 3.93 4 59.0 4.9
258 2 9 4 35.968 71.935 0.381 3.93 8 58.3 9.6
259 0 5 7 36.02 72.041 0.382 3.92 4 81.2 9.3
260 2 2 7 36.057 72.115 0.382 3.91 8 30.4 2.6
261 3 3 6 36.204 72.409 0.383 3.88 8 106.2 31.4
262 2 6 6 36.269 72.539 0.384 3.86 8 47.3 6.2
263 4 6 3 36.307 72.614 0.384 3.86 8 23.5 1.5
264 0 11 3 36.307 72.615 0.384 3.86 4 65.8 6.0
265 5 0 2 36.315 72.629 0.384 3.85 4 2.5 0.0
266 2 11 0 36.32 72.64 0.384 3.85 4 9.2 0.1
267 2 10 3 36.344 72.689 0.385 3.85 8 25.5 1.8
268 3 6 5 36.372 72.744 0.385 3.84 8 38.6 4.1
269 1 10 4 36.422 72.844 0.385 3.83 8 10.1 0.3
270 5 1 2 36.463 72.925 0.386 3.82 8 34.7 3.3
271 4 7 2 36.491 72.981 0.386 3.82 8 6.7 0.1
272 4 0 5 36.547 73.095 0.387 3.81 4 20.7 0.6
273 0 12 0 36.579 73.157 0.387 3.8 2 213.3 31.0
274 2 8 5 36.585 73.169 0.387 3.8 8 111.5 33.9
275 5 3 1 36.602 73.204 0.387 3.8 8 42.4 4.9
276 2 11 1 36.667 73.335 0.388 3.78 8 54.4 8.0
277 4 1 5 36.695 73.39 0.388 3.78 8 43.8 5.2
278 1 9 5 36.741 73.483 0.388 3.77 8 8.2 0.2
279 2 3 7 36.797 73.594 0.389 3.76 8 10.1 0.3
280 1 5 7 36.806 73.612 0.389 3.76 8 71.2 13.7
281 5 2 2 36.905 73.81 0.39 3.74 8 46.5 5.8
282 1 11 3 37.091 74.181 0.391 3.7 8 29.2 2.3
283 4 5 4 37.112 74.224 0.392 3.7 8 77.9 16.1
284 4 2 5 37.136 74.273 0.392 3.69 8 24.9 1.6
285 3 4 6 37.236 74.473 0.393 3.68 8 50.4 6.7
286 0 8 6 37.264 74.528 0.393 3.67 4 22.3 0.7
287 4 8 0 37.314 74.627 0.393 3.66 4 88.9 10.4
288 3 8 4 37.378 74.756 0.394 3.65 8 8.2 0.2
289 3 9 3 37.457 74.914 0.395 3.64 8 58.6 9.0
290 3 10 1 37.484 74.969 0.395 3.63 8 40.7 4.3
291 0 0 8 37.534 75.069 0.395 3.62 2 116.2 8.8
292 5 4 1 37.63 75.26 0.396 3.61 8 80.2 16.6
293 5 3 2 37.638 75.276 0.396 3.61 8 31.9 2.6
294 4 8 1 37.658 75.315 0.397 3.6 8 57.7 8.6
295 2 11 2 37.703 75.405 0.397 3.59 8 27.2 1.9
296 1 12 1 37.704 75.408 0.397 3.59 8 61.9 9.9
297 2 4 7 37.823 75.645 0.398 3.57 8 17.7 0.8
298 4 3 5 37.868 75.735 0.398 3.57 8 1.1 0.0
299 0 12 2 37.958 75.916 0.399 3.55 4 13.0 0.2
300 1 8 6 38.04 76.08 0.4 3.54 8 41.5 4.4
301 5 0 3 38.04 76.081 0.4 3.54 4 40.2 2.1
302 0 2 8 38.118 76.235 0.401 3.52 4 79.8 8.1
303 2 7 6 38.176 76.353 0.401 3.52 8 9.3 0.2
304 5 1 3 38.186 76.372 0.401 3.51 8 112.0 31.6
305 4 7 3 38.213 76.427 0.402 3.51 8 76.8 14.9
306 3 7 5 38.277 76.554 0.402 3.5 8 5.3 0.1
307 1 0 8 38.308 76.617 0.402 3.49 4 41.1 2.1
308 1 6 7 38.414 76.828 0.403 3.48 8 163.8 67.0
309 1 1 8 38.454 76.907 0.404 3.47 8 4.6 0.1
310 3 10 2 38.512 77.024 0.404 3.46 8 0.6 0.0
311 3 5 6 38.548 77.097 0.405 3.46 8 103.3 26.5
312 5 2 3 38.621 77.242 0.405 3.45 8 1.5 0.0
313 5 4 2 38.656 77.312 0.405 3.44 8 141.1 49.1
314 4 8 2 38.684 77.367 0.406 3.44 8 39.7 3.9
315 4 6 4 38.715 77.431 0.406 3.43 8 60.3 8.9
316 1 12 2 38.729 77.459 0.406 3.43 8 11.4 0.3
317 2 10 4 38.752 77.504 0.406 3.43 8 84.7 17.6
318 4 4 5 38.884 77.768 0.407 3.41 8 130.0 41.3
319 1 2 8 38.888 77.776 0.408 3.41 8 5.3 0.1
320 5 5 1 38.938 77.875 0.408 3.4 8 3.4 0.0
321 2 9 5 39.065 78.13 0.409 3.38 8 39.2 3.7
322 2 5 7 39.128 78.256 0.41 3.37 8 11.7 0.3
323 5 3 3 39.344 78.687 0.412 3.34 8 77.0 14.2
324 3 0 7 39.353 78.707 0.412 3.34 4 129.4 20.1
325 2 11 3 39.407 78.814 0.412 3.33 8 42.9 4.4
326 1 11 4 39.483 78.965 0.413 3.32 8 85.1 17.3
327 3 1 7 39.497 78.995 0.413 3.32 8 50.2 6.0
328 1 10 5 39.506 79.013 0.413 3.32 8 2.1 0.0
329 0 7 7 39.525 79.049 0.413 3.32 4 8.3 0.1
330 1 3 8 39.609 79.218 0.414 3.31 8 11.0 0.3
331 2 12 0 39.671 79.343 0.414 3.3 4 78.4 7.3
332 4 9 0 39.779 79.558 0.415 3.28 4 14.4 0.2
333 3 9 4 39.842 79.684 0.416 3.27 8 33.9 2.7
334 0 4 8 39.852 79.703 0.416 3.27 4 8.2 0.1
335 3 2 7 39.929 79.857 0.417 3.26 8 78.6 14.5
336 5 5 2 39.954 79.907 0.417 3.26 8 23.1 1.2
337 2 12 1 40.009 80.018 0.417 3.25 8 67.5 10.6
338 4 9 1 40.116 80.233 0.418 3.24 8 68.3 10.8
339 3 6 6 40.134 80.267 0.418 3.24 8 71.4 11.8
340 4 5 5 40.179 80.359 0.419 3.23 8 39.2 3.6
341 3 10 3 40.206 80.412 0.419 3.23 8 92.8 20.0
342 1 7 7 40.287 80.575 0.42 3.22 8 75.3 13.1
343 4 0 6 40.304 80.607 0.42 3.22 4 2.8 0.0
344 2 8 6 40.34 80.679 0.42 3.21 8 24.3 1.4
345 5 4 3 40.349 80.698 0.42 3.21 8 14.4 0.5
346 4 8 3 40.376 80.752 0.42 3.21 8 41.3 3.9
347 5 0 4 40.415 80.83 0.421 3.2 4 35.2 1.4
348 1 12 3 40.421 80.842 0.421 3.2 8 56.3 7.3
349 3 8 5 40.439 80.878 0.421 3.2 8 12.4 0.4
350 4 1 6 40.447 80.894 0.421 3.2 8 27.2 1.7
351 1 9 6 40.492 80.984 0.421 3.2 8 68.5 10.8
352 5 6 1 40.519 81.038 0.422 3.19 8 51.2 6.0
353 3 11 1 40.519 81.039 0.422 3.19 8 2.5 0.0
354 0 13 1 40.546 81.093 0.422 3.19 4 47.6 2.6
355 5 1 4 40.558 81.116 0.422 3.19 8 52.4 6.3
356 4 7 4 40.585 81.17 0.422 3.18 8 46.6 5.0
357 2 0 8 40.604 81.208 0.422 3.18 4 53.8 3.3
358 1 4 8 40.613 81.226 0.423 3.18 8 74.3 12.6
359 3 3 7 40.645 81.29 0.423 3.18 8 56.9 7.4
360 2 6 7 40.708 81.415 0.423 3.17 8 48.6 5.4
361 2 1 8 40.747 81.493 0.424 3.17 8 11.4 0.3
362 4 2 6 40.876 81.751 0.425 3.15 8 36.4 3.0
363 5 2 4 40.987 81.973 0.426 3.14 8 23.8 1.3
364 2 12 2 41.018 82.037 0.426 3.14 8 13.7 0.4
365 4 9 2 41.125 82.25 0.427 3.12 8 43.3 4.2
366 2 2 8 41.175 82.35 0.427 3.12 8 39.9 3.6
367 1 13 1 41.305 82.609 0.428 3.11 8 47.0 4.9
368 5 6 2 41.525 83.051 0.43 3.08 8 68.2 10.3
369 3 11 2 41.526 83.052 0.43 3.08 8 73.7 12.0
370 4 3 6 41.588 83.177 0.431 3.08 8 33.2 2.4
371 5 5 3 41.633 83.267 0.431 3.07 8 49.1 5.3
372 3 4 7 41.643 83.286 0.431 3.07 8 131.2 37.9
373 5 3 4 41.699 83.398 0.432 3.07 8 55.6 6.8
374 4 6 5 41.749 83.499 0.432 3.06 8 18.1 0.7
375 0 11 5 41.75 83.5 0.432 3.06 4 131.8 19.1
376 2 11 4 41.762 83.524 0.432 3.06 8 12.5 0.3
377 2 10 5 41.785 83.57 0.433 3.06 8 107.1 25.2
378 2 3 8 41.887 83.773 0.433 3.05 8 59.6 7.8
379 1 5 8 41.896 83.791 0.433 3.05 8 23.7 1.2
380 3 7 6 41.988 83.977 0.434 3.04 8 56.6 7.0
381 0 12 4 42.011 84.021 0.434 3.04 4 78.4 6.7
382 1 13 2 42.308 84.616 0.437 3.01 8 6.3 0.1
383 5 7 1 42.37 84.741 0.437 3.01 8 20.3 0.9
384 1 8 7 42.425 84.849 0.438 3.0 8 0.4 0.0
385 0 10 6 42.441 84.882 0.438 3.0 4 14.1 0.2
386 4 10 0 42.489 84.978 0.438 3.0 4 167.5 30.2
387 1 11 5 42.504 85.008 0.439 2.99 8 57.4 7.1
388 3 10 4 42.552 85.103 0.439 2.99 8 75.0 12.1
389 2 7 7 42.558 85.115 0.439 2.99 8 98.6 20.9
390 4 4 6 42.583 85.165 0.439 2.99 8 9.4 0.2
391 2 12 3 42.69 85.38 0.44 2.98 8 91.7 18.0
392 5 4 4 42.693 85.386 0.44 2.98 8 19.7 0.8
393 0 6 8 42.703 85.406 0.44 2.98 4 140.3 21.0
394 4 8 4 42.72 85.439 0.44 2.98 8 47.5 4.8
395 2 9 6 42.76 85.52 0.441 2.97 8 8.6 0.2
396 1 12 4 42.764 85.529 0.441 2.97 8 89.8 17.2
397 4 9 3 42.796 85.592 0.441 2.97 8 27.6 1.6
398 4 10 1 42.823 85.645 0.441 2.97 8 97.6 20.3
399 3 9 5 42.858 85.717 0.442 2.97 8 50.2 5.4
400 2 4 8 42.88 85.76 0.442 2.96 8 49.6 5.2
401 3 5 7 42.921 85.841 0.442 2.96 8 30.8 2.0
402 1 10 6 43.194 86.388 0.444 2.94 8 33.4 2.4
403 5 6 3 43.194 86.388 0.444 2.94 8 26.0 1.4
404 3 11 3 43.195 86.389 0.444 2.94 8 30.2 1.9
405 0 13 3 43.221 86.443 0.445 2.94 4 19.4 0.4
406 2 13 0 43.233 86.467 0.445 2.94 4 74.5 5.8
407 5 7 2 43.37 86.74 0.446 2.93 8 20.0 0.8
408 6 0 0 43.374 86.748 0.446 2.93 2 128.1 8.6
409 0 1 9 43.408 86.816 0.446 2.92 4 5.3 0.0
410 5 0 5 43.424 86.849 0.446 2.92 4 6.0 0.0
411 1 6 8 43.455 86.91 0.446 2.92 8 13.4 0.4
412 6 1 0 43.516 87.031 0.447 2.92 4 89.8 8.4
413 5 1 5 43.566 87.132 0.447 2.91 8 62.8 8.2
414 2 13 1 43.566 87.132 0.447 2.91 8 43.3 3.9
415 4 7 5 43.593 87.185 0.448 2.91 8 112.7 26.6
416 6 0 1 43.707 87.414 0.449 2.9 4 93.9 9.2
417 3 12 1 43.787 87.574 0.449 2.9 8 31.3 2.0
418 4 10 2 43.821 87.642 0.449 2.9 8 5.2 0.1
419 6 1 1 43.848 87.696 0.45 2.89 8 33.3 2.3
420 4 5 6 43.857 87.714 0.45 2.89 8 6.8 0.1
421 6 2 0 43.94 87.88 0.45 2.89 4 53.2 2.9
422 5 5 4 43.967 87.934 0.451 2.89 8 11.3 0.3
423 1 13 3 43.973 87.946 0.451 2.89 8 37.7 2.9
424 5 2 5 43.99 87.98 0.451 2.88 8 49.1 5.0
425 1 0 9 44.018 88.036 0.451 2.88 4 34.6 1.2
426 0 14 0 44.047 88.094 0.451 2.88 2 129.6 8.7
427 0 9 7 44.079 88.159 0.452 2.88 4 78.7 6.4
428 3 8 6 44.113 88.227 0.452 2.88 8 6.0 0.1
429 2 5 8 44.153 88.307 0.452 2.87 8 30.2 1.9
430 1 1 9 44.159 88.318 0.452 2.87 8 20.7 0.9
431 6 2 1 44.272 88.545 0.453 2.87 8 16.0 0.5
432 3 0 8 44.374 88.748 0.454 2.86 4 10.2 0.1
433 3 6 7 44.477 88.953 0.455 2.86 8 96.2 19.0
434 5 8 1 44.494 88.987 0.455 2.86 8 23.4 1.1
435 3 1 8 44.515 89.031 0.455 2.85 8 48.0 4.7
436 0 3 9 44.539 89.078 0.455 2.85 4 24.2 0.6
437 2 13 2 44.564 89.127 0.455 2.85 8 53.0 5.7
438 1 2 9 44.583 89.166 0.456 2.85 8 25.5 1.3
439 4 0 7 44.644 89.289 0.456 2.85 4 34.7 1.2
440 6 3 0 44.647 89.293 0.456 2.85 4 70.2 5.0
441 2 8 7 44.68 89.36 0.456 2.84 8 30.7 1.9
442 5 3 5 44.697 89.394 0.457 2.84 8 27.6 1.6
443 6 0 2 44.704 89.408 0.457 2.84 4 25.4 0.7
444 2 11 5 44.759 89.519 0.457 2.84 8 13.3 0.4
445 3 12 2 44.784 89.569 0.457 2.84 8 18.7 0.7
446 4 1 7 44.786 89.571 0.457 2.84 8 44.1 4.0
447 1 9 7 44.83 89.66 0.458 2.84 8 105.4 22.6
448 6 1 2 44.845 89.691 0.458 2.84 8 43.9 3.9
449 3 2 8 44.939 89.879 0.459 2.83 8 33.9 2.3
450 6 3 1 44.979 89.958 0.459 2.83 8 9.5 0.2
X-ray diffraction powder data (I)...X-Ray wave length = 1.54056 (angs.):
No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si)
( degree ) (angstrem) *100 *100
1 0 1 1 5.216 10.433 8.47246 174.9 13.3 13.5 5.6
2 0 2 0 5.7 11.4 7.75545 75.9 5.8 5.9 5.6
3 1 0 1 7.902 15.804 5.60288 79.8 6.1 6.1 5.6
4 1 1 1 8.405 16.81 5.26962 79.9 6.1 6.1 5.6
5 1 2 1 9.765 19.529 4.54166 145.8 11.1 11.2 5.6
6 1 0 2 10.983 21.967 4.04297 172.2 13.1 13.2 5.6
7 1 1 2 11.355 22.71 3.91226 272.7 20.7 20.9 5.6
8 0 4 0 11.458 22.915 3.87772 96.5 7.3 7.4 5.6
9 1 3 1 11.696 23.392 3.79969 35.4 2.7 2.7 5.6
10 1 2 2 12.407 24.814 3.58507 84.2 6.4 6.4 5.6
11 2 1 0 13.547 27.094 3.28836 317.2 24.1 24.2 5.6
12 1 3 2 13.996 27.992 3.18486 337.3 25.6 25.7 5.6
13 2 2 0 14.45 28.9 3.08683 195.4 14.8 14.9 5.6
14 1 0 3 14.805 29.61 3.01442 264.1 20.1 20.1 5.6
15 0 5 1 15.053 30.107 2.96582 88.4 6.7 6.7 5.6
16 1 1 3 15.089 30.177 2.95905 177.1 13.4 13.5 5.6
17 2 2 1 15.123 30.247 2.95241 174.8 13.3 13.3 5.6
18 2 3 0 15.851 31.701 2.8202 1316.6 100.0 100.0 5.6
19 1 2 3 15.912 31.823 2.80965 14.6 1.1 1.1 5.6
20 1 4 2 15.976 31.953 2.79856 78.3 5.9 5.9 5.6
21 1 5 1 16.488 32.977 2.71396 73.0 5.5 5.5 5.6
22 1 3 3 17.205 34.41 2.60414 430.6 32.7 32.6 5.7
23 0 6 0 17.335 34.671 2.58515 360.8 27.4 27.3 5.7
24 2 4 0 17.643 35.286 2.54143 120.1 9.1 9.1 5.7
25 0 0 4 17.735 35.47 2.52868 32.0 2.4 2.4 5.7
26 2 4 1 18.211 36.421 2.46482 75.7 5.7 5.7 5.7
27 2 0 3 18.87 37.74 2.38168 101.6 7.7 7.7 5.7
28 1 0 4 18.991 37.981 2.36709 21.6 1.6 1.6 5.7
29 1 1 4 19.219 38.438 2.34 28.4 2.2 2.1 5.7
30 0 6 2 19.55 39.101 2.30186 125.9 9.6 9.5 5.7
31 0 5 3 19.72 39.439 2.28288 29.8 2.3 2.2 5.7
32 2 4 2 19.829 39.657 2.27083 149.9 11.4 11.3 5.7
33 2 5 1 20.255 40.511 2.22492 50.1 3.8 3.8 5.7
34 1 6 2 20.712 41.424 2.17797 141.9 10.8 10.7 5.7
35 3 1 1 20.806 41.613 2.16851 93.5 7.1 7.0 5.7
36 1 5 3 20.873 41.746 2.16188 16.6 1.3 1.2 5.7
37 0 4 4 21.325 42.651 2.11811 21.3 1.6 1.6 5.7
38 3 2 1 21.437 42.874 2.1076 29.3 2.2 2.2 5.7
39 2 5 2 21.745 43.491 2.07913 17.8 1.4 1.3 5.7
40 3 1 2 22.266 44.532 2.03288 181.6 13.8 13.6 5.7
41 2 4 3 22.306 44.612 2.02945 27.0 2.0 2.0 5.7
42 3 3 1 22.456 44.912 2.01658 14.9 1.1 1.1 5.7
43 0 1 5 22.582 45.163 2.00595 108.2 8.2 8.1 5.7
44 1 6 3 23.112 46.224 1.96235 179.0 13.6 13.4 5.7
45 2 2 4 23.19 46.38 1.95613 20.7 1.6 1.6 5.7
46 1 0 5 23.428 46.857 1.93731 107.0 8.1 8.0 5.7
47 3 3 2 23.835 47.67 1.90613 13.5 1.0 1.0 5.7
48 2 5 3 24.063 48.126 1.88913 35.6 2.7 2.7 5.7
49 0 3 5 24.135 48.269 1.88388 323.7 24.6 24.2 5.7
50 1 2 5 24.194 48.387 1.87955 27.7 2.1 2.1 5.7
51 3 0 3 24.358 48.716 1.86763 177.7 13.5 13.3 5.7
52 2 7 0 24.597 49.193 1.85062 76.8 5.8 5.7 5.7
53 2 7 1 25.033 50.066 1.8204 96.8 7.3 7.2 5.7
54 3 2 3 25.102 50.204 1.81572 143.7 10.9 10.7 5.7
55 0 6 4 25.221 50.443 1.80768 66.6 5.1 5.0 5.8
56 1 7 3 25.559 51.118 1.78538 106.8 8.1 8.0 5.8
57 3 3 3 26.01 52.019 1.75654 32.3 2.5 2.4 5.8
58 2 6 3 26.088 52.176 1.75162 211.9 16.1 15.8 5.8
59 1 8 2 26.143 52.285 1.74823 93.6 7.1 7.0 5.8
60 2 0 5 26.378 52.756 1.73374 76.7 5.8 5.7 5.8
61 0 5 5 27.038 54.076 1.69449 58.3 4.4 4.3 5.8
62 3 4 3 27.244 54.488 1.68264 167.2 12.7 12.4 5.8
63 2 8 0 27.292 54.583 1.67993 20.3 1.5 1.5 5.8
64 3 0 4 27.324 54.648 1.67809 19.2 1.5 1.4 5.8
65 4 1 0 27.421 54.842 1.67261 41.5 3.2 3.1 5.8
66 2 8 1 27.697 55.395 1.65723 19.9 1.5 1.5 5.8
67 4 2 0 27.936 55.872 1.64418 99.0 7.5 7.3 5.8
68 3 2 4 28.011 56.022 1.64013 22.3 1.7 1.6 5.8
69 4 2 1 28.336 56.672 1.62288 16.3 1.2 1.2 5.8
70 3 6 2 28.651 57.301 1.60653 30.6 2.3 2.3 5.8
71 4 3 0 28.781 57.563 1.59985 20.6 1.6 1.5 5.8
72 2 6 4 28.928 57.856 1.59243 16.0 1.2 1.2 5.8
73 1 9 2 29.069 58.138 1.5854 21.7 1.6 1.6 5.8
74 2 4 5 29.122 58.244 1.58275 20.5 1.6 1.5 5.8
75 1 3 6 29.607 59.213 1.55913 27.4 2.1 2.0 5.8
76 3 7 1 29.638 59.276 1.55763 14.1 1.1 1.0 5.8
77 1 6 5 29.793 59.585 1.55029 19.2 1.5 1.4 5.8
78 4 4 0 29.939 59.878 1.54342 24.7 1.9 1.8 5.8
79 2 9 0 30.143 60.286 1.53394 132.1 10.0 9.7 5.8
80 3 6 3 30.585 61.169 1.51389 28.5 2.2 2.1 5.8
81 3 7 2 30.784 61.569 1.50501 95.9 7.3 7.0 5.8
82 4 1 3 30.936 61.872 1.49837 57.4 4.4 4.2 5.8
83 1 9 3 30.987 61.973 1.49616 37.8 2.9 2.8 5.8
84 0 7 5 31.037 62.073 1.49399 20.8 1.6 1.5 5.8
85 4 2 3 31.415 62.829 1.47782 24.5 1.9 1.8 5.9
86 4 4 2 31.453 62.906 1.4762 17.8 1.3 1.3 5.9
87 1 10 2 32.134 64.268 1.44817 38.3 2.9 2.8 5.9
88 4 6 0 33.111 66.221 1.4101 16.5 1.3 1.2 5.9
89 3 8 2 33.145 66.29 1.40882 14.6 1.1 1.1 5.9
90 3 4 5 33.358 66.716 1.40084 43.6 3.3 3.2 5.9
91 0 11 1 33.473 66.947 1.39658 29.8 2.3 2.2 5.9
92 0 3 7 33.608 67.216 1.39163 13.6 1.0 1.0 5.9
93 1 6 6 33.874 67.749 1.38198 46.9 3.6 3.4 5.9
94 1 8 5 34.199 68.398 1.37043 41.0 3.1 3.0 5.9
95 1 3 7 34.417 68.835 1.3628 74.1 5.6 5.4 5.9
96 4 5 3 34.662 69.325 1.35436 17.9 1.4 1.3 5.9
97 4 3 4 34.732 69.464 1.35198 13.4 1.0 1.0 5.9
98 3 0 6 34.86 69.719 1.34766 20.4 1.6 1.5 5.9
99 4 7 0 35.09 70.179 1.33995 51.3 3.9 3.7 5.9
100 1 11 2 35.348 70.696 1.33143 51.1 3.9 3.7 5.9
101 1 4 7 35.471 70.942 1.32741 26.9 2.0 1.9 5.9
102 2 1 7 35.611 71.222 1.32288 17.8 1.4 1.3 5.9
103 4 4 4 35.781 71.563 1.31741 19.6 1.5 1.4 5.9
104 2 9 4 35.968 71.935 1.31149 14.5 1.1 1.0 5.9
105 3 3 6 36.204 72.409 1.30409 31.4 2.4 2.3 5.9
106 2 8 5 36.585 73.169 1.2924 69.8 5.3 5.0 6.0
107 2 11 1 36.667 73.335 1.28989 13.2 1.0 1.0 6.0
108 1 5 7 36.806 73.612 1.28571 13.7 1.0 1.0 6.0
109 4 5 4 37.112 74.224 1.27662 20.0 1.5 1.4 6.0
110 3 9 3 37.457 74.914 1.26656 13.3 1.0 1.0 6.0
111 5 4 1 37.63 75.26 1.26159 27.9 2.1 2.0 6.0
112 5 1 3 38.186 76.372 1.24598 46.5 3.5 3.3 6.0
113 1 6 7 38.414 76.828 1.23971 67.0 5.1 4.8 6.0
114 3 5 6 38.548 77.097 1.23606 26.5 2.0 1.9 6.0
115 5 4 2 38.656 77.312 1.23315 53.0 4.0 3.8 6.0
116 2 10 4 38.752 77.504 1.23058 17.6 1.3 1.3 6.0
117 4 4 5 38.884 77.768 1.22706 41.4 3.1 2.9 6.0
118 3 0 7 39.353 78.707 1.21476 34.3 2.6 2.4 6.0
119 1 11 4 39.483 78.965 1.21143 23.3 1.8 1.7 6.0
120 3 2 7 39.929 79.857 1.20012 15.7 1.2 1.1 6.0
121 3 6 6 40.134 80.267 1.19502 22.7 1.7 1.6 6.0
122 3 10 3 40.206 80.412 1.19323 23.5 1.8 1.7 6.0
123 1 9 6 40.492 80.984 1.18625 16.8 1.3 1.2 6.1
124 1 4 8 40.613 81.226 1.18333 20.9 1.6 1.5 6.1
125 3 11 2 41.526 83.052 1.16188 22.3 1.7 1.6 6.1
126 3 4 7 41.643 83.286 1.15921 43.3 3.3 3.0 6.1
127 0 11 5 41.75 83.5 1.15679 19.4 1.5 1.4 6.1
128 2 10 5 41.785 83.57 1.15599 25.2 1.9 1.8 6.1
129 3 7 6 41.988 83.977 1.15142 13.7 1.0 1.0 6.1
130 4 10 0 42.489 84.978 1.14039 37.3 2.8 2.6 6.1
131 2 7 7 42.558 85.115 1.13891 33.0 2.5 2.3 6.1
132 0 6 8 42.703 85.406 1.13578 44.7 3.4 3.1 6.1
133 1 12 4 42.764 85.529 1.13446 17.2 1.3 1.2 6.1
134 4 10 1 42.823 85.645 1.13321 21.9 1.7 1.5 6.1
135 4 7 5 43.593 87.185 1.11711 38.7 2.9 2.7 6.2
136 3 6 7 44.477 88.953 1.09943 20.1 1.5 1.4 6.2
137 1 9 7 44.83 89.66 1.09258 26.6 2.0 1.8 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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