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 ***
***********************
POLLUCITE
5, f-feldspathoid, DN
Cs(0.8)Na(0.1)Al(0.8)Si(22)O(6).0.2H(2)O
Tetragonal * I4(1)/acd Z = 16
R =0.057 NR =1005
14 .11 .1995
Ref.Str.:
Frank-Kamenetskaya O.V., Rozhdestvenskaya I.V., Bannova I.I.,
Kostitsyna A.V., Kaminskaya T.N., Gordienko V.V. (1995)
* Kristallogr., 40, 4, 698-707
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 13.677 alpha = 90.0
b = 13.677 beta = 90.0
c = 13.691 gamma = 90.0
Unit cell volume (cub. angs.) = 2561.04
Molar volume ( cub.cm/mol.) = 96.41
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.1248 0.1252 0.125 2.76 Cs = 0.81, H(2)O = 0.23
2 0.25 0.11 0.0 7.0 Na = 0.12, Na = 0.0
3 0.3751 0.3376 0.088 1.41 Al = 0.27, Si = 0.73
4 0.162 0.412 0.125 1.27 Al = 0.27, Si = 0.73
5 0.3842 0.3544 0.9695 3.49 O = 1.00
6 0.2806 0.3968 0.133 3.46 O = 1.00
7 0.366 0.2197 0.1052 3.02 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.1248 0.1252 0.125
2 2 0.25 0.11 0.0
3 3 0.3751 0.3376 0.088
4 4 0.162 0.412 0.125
5 5 0.3842 0.3544 0.9695
6 6 0.2806 0.3968 0.133
7 7 0.366 0.2197 0.1052
8 1 0.8752 0.8748 0.875
9 2 0.75 0.89 0.0
10 3 0.6249 0.6624 0.912
11 4 0.838 0.588 0.875
12 5 0.6158 0.6456 0.0305
13 6 0.7194 0.6032 0.867
14 7 0.634 0.7803 0.8948
15 1 0.6248 0.1252 0.375
16 2 0.75 0.11 0.5
17 3 0.8751 0.3376 0.412
18 4 0.662 0.412 0.375
19 5 0.8842 0.3544 0.5305
20 6 0.7806 0.3968 0.367
21 7 0.866 0.2197 0.3948
22 1 0.3752 0.8748 0.625
23 2 0.25 0.89 0.5
24 3 0.1249 0.6624 0.588
25 4 0.338 0.588 0.625
26 5 0.1158 0.6456 0.4695
27 6 0.2194 0.6032 0.633
28 7 0.134 0.7803 0.6052
29 1 0.1248 0.6252 0.875
30 2 0.25 0.61 0.0
31 3 0.3751 0.8376 0.912
32 4 0.162 0.912 0.875
33 5 0.3842 0.8544 0.0305
34 6 0.2806 0.8968 0.867
35 7 0.366 0.7197 0.8948
36 1 0.8752 0.3748 0.125
37 2 0.75 0.39 0.0
38 3 0.6249 0.1624 0.088
39 4 0.838 0.088 0.125
40 5 0.6158 0.1456 0.9695
41 6 0.7194 0.1032 0.133
42 7 0.634 0.2803 0.1052
43 1 0.6248 0.6252 0.625
44 2 0.75 0.61 0.5
45 3 0.8751 0.8376 0.588
46 4 0.662 0.912 0.625
47 5 0.8842 0.8544 0.4695
48 6 0.7806 0.8968 0.633
49 7 0.866 0.7197 0.6052
50 1 0.3752 0.3748 0.375
51 2 0.25 0.39 0.5
52 3 0.1249 0.1624 0.412
53 4 0.338 0.088 0.375
54 5 0.1158 0.1456 0.5305
55 6 0.2194 0.1032 0.367
56 7 0.134 0.2803 0.3948
57 1 0.8752 0.1252 0.625
58 3 0.6249 0.3376 0.588
59 4 0.838 0.412 0.625
60 5 0.6158 0.3544 0.4695
61 6 0.7194 0.3968 0.633
62 7 0.634 0.2197 0.6052
63 1 0.1248 0.8748 0.375
64 3 0.3751 0.6624 0.412
65 4 0.162 0.588 0.375
66 5 0.3842 0.6456 0.5305
67 6 0.2806 0.6032 0.367
68 7 0.366 0.7803 0.3948
69 1 0.3752 0.1252 0.875
70 3 0.1249 0.3376 0.912
71 4 0.338 0.412 0.875
72 5 0.1158 0.3544 0.0305
73 6 0.2194 0.3968 0.867
74 7 0.134 0.2197 0.8948
75 1 0.6248 0.8748 0.125
76 3 0.8751 0.6624 0.088
77 4 0.662 0.588 0.125
78 5 0.8842 0.6456 0.9695
79 6 0.7806 0.6032 0.133
80 7 0.866 0.7803 0.1052
81 1 0.8752 0.6252 0.375
82 3 0.6249 0.8376 0.412
83 4 0.838 0.912 0.375
84 5 0.6158 0.8544 0.5305
85 6 0.7194 0.8968 0.367
86 7 0.634 0.7197 0.3948
87 1 0.1248 0.3748 0.625
88 3 0.3751 0.1624 0.588
89 4 0.162 0.088 0.625
90 5 0.3842 0.1456 0.4695
91 6 0.2806 0.1032 0.633
92 7 0.366 0.2803 0.6052
93 1 0.3752 0.6252 0.125
94 3 0.1249 0.8376 0.088
95 4 0.338 0.912 0.125
96 5 0.1158 0.8544 0.9695
97 6 0.2194 0.8968 0.133
98 7 0.134 0.7197 0.1052
99 1 0.6248 0.3748 0.875
100 3 0.8751 0.1624 0.912
101 4 0.662 0.088 0.875
102 5 0.8842 0.1456 0.0305
103 6 0.7806 0.1032 0.867
104 7 0.866 0.2803 0.8948
105 2 0.64 0.5 0.75
106 2 0.86 0.5 0.25
107 3 0.4124 0.6251 0.838
108 3 0.0876 0.3749 0.338
109 5 0.3956 0.6342 0.7195
110 5 0.1044 0.3658 0.2195
111 6 0.3532 0.5306 0.883
112 6 0.1468 0.4694 0.383
113 7 0.5303 0.616 0.8552
114 7 0.9697 0.384 0.3552
115 2 0.86 0.0 0.75
116 2 0.64 0.0 0.25
117 3 0.0876 0.8749 0.662
118 3 0.4124 0.1251 0.162
119 5 0.1044 0.8658 0.7805
120 5 0.3956 0.1342 0.2805
121 6 0.1468 0.9694 0.617
122 6 0.3532 0.0306 0.117
123 7 0.9697 0.884 0.6448
124 7 0.5303 0.116 0.1448
125 2 0.14 0.5 0.75
126 2 0.36 0.5 0.25
127 3 0.9124 0.6251 0.662
128 3 0.5876 0.3749 0.162
129 5 0.8956 0.6342 0.7805
130 5 0.6044 0.3658 0.2805
131 6 0.8532 0.5306 0.617
132 6 0.6468 0.4694 0.117
133 7 0.0303 0.616 0.6448
134 7 0.4697 0.384 0.1448
135 2 0.36 0.0 0.75
136 2 0.14 0.0 0.25
137 3 0.5876 0.8749 0.838
138 3 0.9124 0.1251 0.338
139 5 0.6044 0.8658 0.7195
140 5 0.8956 0.1342 0.2195
141 6 0.6468 0.9694 0.883
142 6 0.8532 0.0306 0.383
143 7 0.4697 0.884 0.8552
144 7 0.0303 0.116 0.3552
145 3 0.4124 0.8749 0.338
146 3 0.0876 0.1251 0.838
147 5 0.3956 0.8658 0.2195
148 5 0.1044 0.1342 0.7195
149 6 0.3532 0.9694 0.383
150 6 0.1468 0.0306 0.883
151 7 0.5303 0.884 0.3552
152 7 0.9697 0.116 0.8552
153 3 0.0876 0.6251 0.162
154 3 0.4124 0.3749 0.662
155 5 0.1044 0.6342 0.2805
156 5 0.3956 0.3658 0.7805
157 6 0.1468 0.5306 0.117
158 6 0.3532 0.4694 0.617
159 7 0.9697 0.616 0.1448
160 7 0.5303 0.384 0.6448
161 3 0.9124 0.8749 0.162
162 3 0.5876 0.1251 0.662
163 5 0.8956 0.8658 0.2805
164 5 0.6044 0.1342 0.7805
165 6 0.8532 0.9694 0.117
166 6 0.6468 0.0306 0.617
167 7 0.0303 0.884 0.1448
168 7 0.4697 0.116 0.6448
169 3 0.5876 0.6251 0.338
170 3 0.9124 0.3749 0.838
171 5 0.6044 0.6342 0.2195
172 5 0.8956 0.3658 0.7195
173 6 0.6468 0.5306 0.383
174 6 0.8532 0.4694 0.883
175 7 0.4697 0.616 0.3552
176 7 0.0303 0.384 0.8552
X-ray density (g/cm cub.) = 3.05
MU (1/cm) = 417.505 Mass attenuation coefficient (cm**2/g) = 136.972
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Cs ,H(2)O 3.78 12
3.5534 7
3.5696 6
3.3935 5
3.4087 7
3.3829 6
3.5469 5
3.5469 5
3.3829 6
3.3935 5
3.4087 7
3.5696 6
3.5534 7
2 Na ,Na 2.976 4
2.6158 7
2.6158 7
2.3953 6
2.3953 6
3 Al ,Si 2.484 4
1.6433 5
1.6449 6
1.6344 7
1.6375 7
4 Al ,Si 2.484 4
1.639 6
1.6413 5
1.6413 5
1.639 6
5 O 3.432 6
2.712 6
2.6282 7
2.7177 6
2.7184 6
2.7003 7
2.597 5
6 O 3.432 6
2.712 5
2.7159 7
2.7177 5
2.7184 5
2.5973 7
2.5972 6
7 O 3.432 6
2.6282 5
2.7159 6
2.7003 5
2.5973 6
2.712 7
2.712 7
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 2 0 0 6.467 12.935 0.073 154.67 4 9.6 0.9
2 1 1 2 7.924 15.848 0.089 102.29 8 52.9 34.8
3 2 1 1 7.928 15.856 0.09 102.18 16 61.5 94.3
4 2 0 2 9.161 18.323 0.103 75.97 8 81.6 61.6
5 2 2 0 9.166 18.332 0.103 75.89 4 80.8 30.2
6 2 1 3 12.157 24.314 0.137 42.22 16 237.7 581.8
7 3 1 2 12.161 24.323 0.137 42.19 16 243.9 612.5
8 3 2 1 12.164 24.328 0.137 42.17 16 236.4 574.9
9 0 0 4 13.006 26.011 0.146 36.63 2 1174.5 1540.8
10 4 0 0 13.019 26.038 0.146 36.55 4 1180.8 3108.1
11 4 1 1 13.823 27.647 0.155 32.19 16 0.4 0.0
12 2 0 4 14.576 29.152 0.163 28.76 8 84.7 25.2
13 4 0 2 14.585 29.17 0.163 28.72 8 78.2 21.4
14 4 2 0 14.588 29.176 0.163 28.71 8 94.9 31.5
15 3 2 3 15.311 30.621 0.171 25.88 16 469.8 1393.6
16 3 3 2 15.314 30.628 0.171 25.87 8 463.6 678.2
17 2 2 4 16.005 32.01 0.179 23.52 8 51.7 7.7
18 4 2 2 16.013 32.027 0.179 23.5 16 60.2 20.8
19 3 1 4 16.678 33.356 0.186 21.52 16 109.9 63.4
20 4 1 3 16.683 33.365 0.186 21.5 16 115.0 69.4
21 4 3 1 16.688 33.376 0.186 21.49 16 106.7 59.7
22 2 1 5 17.951 35.903 0.2 18.33 16 127.3 72.4
23 5 1 2 17.965 35.93 0.2 18.3 16 138.3 85.4
24 5 2 1 17.967 35.933 0.2 18.29 16 128.8 74.0
25 4 0 4 18.568 37.136 0.207 17.02 8 660.2 904.6
26 4 4 0 18.578 37.155 0.207 17.0 4 646.2 432.8
27 4 3 3 19.166 38.332 0.213 15.87 16 0.6 0.0
28 4 2 4 19.741 39.481 0.219 14.86 16 9.2 0.3
29 6 0 0 19.75 39.5 0.219 14.85 4 2.5 0.0
30 1 1 6 20.294 40.588 0.225 13.97 8 90.3 13.9
31 3 2 5 20.3 40.601 0.225 13.96 16 237.6 192.3
32 5 2 3 20.31 40.619 0.225 13.95 16 233.6 185.8
33 5 3 2 20.312 40.625 0.225 13.95 16 236.7 190.6
34 6 1 1 20.314 40.628 0.225 13.94 16 98.9 33.3
35 2 0 6 20.847 41.693 0.231 13.16 8 89.3 12.8
36 6 0 2 20.864 41.729 0.231 13.14 8 81.8 10.7
37 6 2 0 20.867 41.733 0.231 13.13 8 95.6 14.6
38 4 1 5 21.393 42.787 0.237 12.42 16 37.9 4.4
39 5 1 4 21.398 42.797 0.237 12.41 16 31.5 3.0
40 5 4 1 21.406 42.813 0.237 12.4 16 29.1 2.6
41 6 2 2 21.934 43.869 0.242 11.74 16 3.9 0.0
42 3 1 6 22.437 44.874 0.248 11.16 16 195.0 103.5
43 6 1 3 22.451 44.903 0.248 11.14 16 190.9 99.1
44 6 3 1 22.456 44.911 0.248 11.14 16 192.3 100.5
45 4 4 4 22.958 45.916 0.253 10.59 8 365.5 172.6
46 4 3 5 23.455 46.911 0.258 10.09 16 39.7 3.9
47 5 3 4 23.46 46.92 0.258 10.09 16 40.5 4.0
48 5 4 3 23.464 46.927 0.258 10.08 16 38.1 3.6
49 4 0 6 23.944 47.887 0.263 9.63 8 154.8 28.2
50 6 0 4 23.954 47.907 0.264 9.62 8 152.5 27.3
51 6 4 0 23.962 47.923 0.264 9.61 8 158.6 29.5
52 2 1 7 24.423 48.847 0.268 9.21 16 222.4 111.1
53 3 3 6 24.43 48.86 0.268 9.2 8 316.3 112.3
54 5 2 5 24.435 48.871 0.269 9.2 16 166.4 62.1
55 6 3 3 24.443 48.886 0.269 9.19 16 315.9 223.8
56 5 5 2 24.446 48.891 0.269 9.19 8 162.2 29.5
57 7 1 2 24.446 48.891 0.269 9.19 16 214.5 103.1
58 7 2 1 24.447 48.894 0.269 9.19 16 223.6 112.0
59 4 2 6 24.909 49.818 0.273 8.8 16 63.5 8.7
60 6 2 4 24.919 49.837 0.273 8.8 16 65.7 9.3
61 6 4 2 24.925 49.849 0.274 8.79 16 63.4 8.6
62 3 2 7 26.302 52.604 0.288 7.78 16 376.3 268.6
63 5 1 6 26.308 52.616 0.288 7.77 16 103.8 20.4
64 6 1 5 26.313 52.626 0.288 7.77 16 98.5 18.4
65 7 2 3 26.321 52.641 0.288 7.76 16 379.0 272.1
66 7 3 2 26.323 52.646 0.288 7.76 16 382.0 276.3
67 6 5 1 26.324 52.649 0.288 7.76 16 97.4 18.0
68 0 0 8 26.75 53.499 0.292 7.48 2 609.9 84.9
69 8 0 0 26.779 53.559 0.292 7.46 4 595.4 161.4
70 4 1 7 27.206 54.412 0.297 7.2 16 122.8 26.5
71 5 4 5 27.217 54.434 0.297 7.19 16 0.3 0.0
72 7 1 4 27.221 54.442 0.297 7.19 16 121.3 25.8
73 7 4 1 27.228 54.456 0.297 7.19 16 121.6 25.9
74 8 1 1 27.228 54.456 0.297 7.19 16 1.2 0.0
75 2 0 8 27.644 55.288 0.301 6.94 8 102.2 8.9
76 6 4 4 27.666 55.331 0.301 6.93 16 2.8 0.0
77 8 0 2 27.671 55.342 0.301 6.93 8 99.5 8.4
78 8 2 0 27.673 55.346 0.301 6.93 8 100.8 8.6
79 5 3 6 28.096 56.192 0.306 6.69 16 156.6 40.0
80 6 3 5 28.101 56.202 0.306 6.69 16 156.3 39.9
81 6 5 3 28.108 56.217 0.306 6.69 16 150.5 36.9
82 2 2 8 28.519 57.038 0.31 6.47 8 40.7 1.3
83 6 0 6 28.531 57.063 0.31 6.46 8 123.1 12.0
84 8 2 2 28.546 57.091 0.31 6.46 16 40.5 2.6
85 6 6 0 28.547 57.095 0.31 6.46 4 118.6 5.5
86 3 1 8 28.95 57.9 0.314 6.25 16 118.3 21.3
87 4 3 7 28.957 57.914 0.314 6.25 16 43.5 2.9
88 7 3 4 28.971 57.942 0.314 6.24 16 38.8 2.3
89 7 4 3 28.974 57.949 0.314 6.24 16 37.8 2.2
90 8 1 3 28.974 57.949 0.314 6.24 16 121.8 22.6
91 8 3 1 28.978 57.956 0.314 6.24 16 113.7 19.7
92 6 2 6 29.389 58.779 0.319 6.05 16 1.4 0.0
93 5 2 7 29.807 59.614 0.323 5.86 16 197.1 55.5
94 7 2 5 29.817 59.635 0.323 5.85 16 201.5 58.0
95 7 5 2 29.826 59.653 0.323 5.85 16 200.9 57.6
96 4 0 8 30.22 60.44 0.327 5.68 8 385.4 102.9
97 8 0 4 30.241 60.481 0.327 5.67 8 377.4 98.5
98 8 4 0 30.247 60.495 0.327 5.67 8 381.2 100.5
99 8 3 3 30.66 61.319 0.331 5.5 16 0.9 0.0
100 4 2 8 31.049 62.098 0.335 5.35 16 44.0 2.5
101 8 2 4 31.069 62.139 0.335 5.34 16 52.7 3.6
102 8 4 2 31.074 62.149 0.335 5.34 16 50.3 3.3
103 2 1 9 31.452 62.904 0.339 5.2 16 33.9 1.5
104 6 1 7 31.465 62.93 0.339 5.19 16 184.5 43.1
105 5 5 6 31.471 62.941 0.339 5.19 8 123.3 9.6
106 7 1 6 31.471 62.941 0.339 5.19 16 181.6 41.8
107 6 5 5 31.475 62.95 0.339 5.19 16 124.1 19.5
108 9 1 2 31.484 62.968 0.339 5.19 16 35.9 1.6
109 7 6 1 31.485 62.97 0.339 5.19 16 191.0 46.1
110 9 2 1 31.485 62.97 0.339 5.19 16 33.5 1.4
111 6 4 6 31.877 63.755 0.343 5.05 16 79.2 7.7
112 6 6 4 31.886 63.771 0.343 5.05 8 83.4 4.3
113 5 1 8 32.27 64.539 0.347 4.92 16 29.6 1.1
114 5 4 7 32.276 64.552 0.347 4.91 16 72.6 6.3
115 7 4 5 32.286 64.571 0.347 4.91 16 68.8 5.7
116 8 1 5 32.286 64.571 0.347 4.91 16 33.9 1.4
117 7 5 4 32.289 64.579 0.347 4.91 16 71.3 6.1
118 8 5 1 32.296 64.591 0.347 4.91 16 26.1 0.8
119 3 2 9 33.063 66.125 0.354 4.67 16 36.8 1.5
120 6 3 7 33.076 66.151 0.354 4.66 16 259.1 76.4
121 7 3 6 33.081 66.162 0.354 4.66 16 266.0 80.4
122 7 6 3 33.092 66.184 0.354 4.66 16 265.4 80.0
123 9 2 3 33.092 66.184 0.354 4.66 16 30.7 1.1
124 9 3 2 33.094 66.188 0.354 4.66 16 40.1 1.8
125 4 4 8 33.466 66.932 0.358 4.55 8 251.5 35.1
126 8 4 4 33.485 66.97 0.358 4.54 16 256.0 72.6
127 4 1 9 33.853 67.706 0.362 4.44 16 36.9 1.5
128 5 3 8 33.86 67.719 0.362 4.44 16 53.4 3.1
129 8 3 5 33.875 67.751 0.362 4.43 16 54.6 3.2
130 9 1 4 33.879 67.758 0.362 4.43 16 35.9 1.4
131 8 5 3 33.882 67.764 0.362 4.43 16 51.7 2.9
132 9 4 1 33.885 67.77 0.362 4.43 16 32.0 1.1
133 6 0 8 34.251 68.503 0.365 4.33 8 151.2 12.1
134 8 0 6 34.263 68.525 0.365 4.33 8 150.0 11.9
135 8 6 0 34.277 68.554 0.366 4.33 8 150.9 12.0
136 10 0 0 34.277 68.554 0.366 4.33 4 4.4 0.0
137 1 1 10 34.627 69.253 0.369 4.24 8 281.8 41.0
138 7 2 7 34.647 69.294 0.369 4.23 16 349.2 125.8
139 7 7 2 34.665 69.33 0.369 4.23 8 340.8 59.9
140 10 1 1 34.666 69.332 0.369 4.23 16 289.1 86.1
141 2 0 10 35.014 70.029 0.372 4.14 8 57.2 1.7
142 6 2 8 35.029 70.057 0.373 4.14 16 58.2 3.4
143 8 2 6 35.04 70.079 0.373 4.14 16 57.1 3.3
144 8 6 2 35.052 70.105 0.373 4.13 16 52.9 2.8
145 10 0 2 35.052 70.105 0.373 4.13 8 50.8 1.3
146 10 2 0 35.054 70.108 0.373 4.13 8 54.7 1.5
147 4 3 9 35.408 70.815 0.376 4.05 16 14.0 0.2
148 9 3 4 35.433 70.866 0.376 4.04 16 14.6 0.2
149 9 4 3 35.436 70.872 0.376 4.04 16 18.2 0.3
150 10 2 2 35.822 71.644 0.38 3.96 16 1.6 0.0
151 3 1 10 36.166 72.333 0.383 3.88 16 247.9 58.2
152 5 2 9 36.174 72.348 0.383 3.88 16 121.0 13.9
153 6 5 7 36.186 72.373 0.383 3.88 16 144.3 19.7
154 7 5 6 36.191 72.383 0.383 3.88 16 149.5 21.2
155 7 6 5 36.196 72.391 0.383 3.88 16 152.4 22.0
156 9 2 5 36.196 72.391 0.383 3.88 16 117.6 13.1
157 10 1 3 36.202 72.404 0.383 3.88 16 250.9 59.5
158 9 5 2 36.204 72.408 0.383 3.88 16 126.1 15.0
159 10 3 1 36.205 72.41 0.383 3.88 16 247.7 58.0
160 7 1 8 36.94 73.88 0.39 3.73 16 145.0 19.1
161 7 4 7 36.946 73.892 0.39 3.73 16 0.2 0.0
162 8 1 7 36.946 73.892 0.39 3.73 16 147.2 19.7
163 8 5 5 36.955 73.911 0.39 3.73 16 1.0 0.0
164 8 7 1 36.965 73.929 0.39 3.73 16 147.8 19.8
165 4 0 10 37.304 74.608 0.393 3.66 8 96.2 4.1
166 6 4 8 37.318 74.636 0.394 3.66 16 57.6 3.0
167 8 4 6 37.329 74.657 0.394 3.66 16 59.5 3.2
168 8 6 4 37.336 74.673 0.394 3.66 16 62.4 3.5
169 10 0 4 37.336 74.673 0.394 3.66 8 96.4 4.2
170 10 4 0 37.342 74.685 0.394 3.66 8 101.2 4.6
171 3 3 10 37.68 75.361 0.397 3.6 8 242.0 25.7
172 6 1 9 37.688 75.375 0.397 3.6 16 22.7 0.5
173 9 1 6 37.705 75.41 0.397 3.59 16 24.1 0.5
174 10 3 3 37.715 75.43 0.397 3.59 16 240.3 50.6
175 9 6 1 37.718 75.437 0.397 3.59 16 22.0 0.4
176 4 2 10 38.055 76.111 0.4 3.53 16 41.6 1.5
177 10 2 4 38.087 76.175 0.4 3.53 16 34.9 1.1
178 10 4 2 38.092 76.184 0.4 3.53 16 38.3 1.3
179 5 4 9 38.436 76.873 0.404 3.47 16 35.8 1.1
180 7 3 8 38.443 76.886 0.404 3.47 16 49.9 2.1
181 8 3 7 38.449 76.897 0.404 3.47 16 55.9 2.6
182 9 4 5 38.458 76.916 0.404 3.47 16 29.0 0.7
183 9 5 4 38.461 76.922 0.404 3.47 16 33.8 1.0
184 8 7 3 38.464 76.928 0.404 3.47 16 53.3 2.4
185 2 1 11 39.166 78.331 0.41 3.37 16 74.4 4.5
186 5 1 10 39.173 78.347 0.41 3.36 16 241.3 47.8
187 6 3 9 39.181 78.361 0.41 3.36 16 7.9 0.1
188 9 3 6 39.198 78.395 0.41 3.36 16 9.0 0.1
189 10 1 5 39.202 78.404 0.41 3.36 16 242.8 48.3
190 9 6 3 39.208 78.416 0.41 3.36 16 2.3 0.0
191 11 1 2 39.21 78.42 0.41 3.36 16 72.6 4.3
192 10 5 1 39.211 78.422 0.41 3.36 16 241.2 47.7
193 11 2 1 39.211 78.422 0.41 3.36 16 75.0 4.6
194 8 0 8 39.558 79.115 0.413 3.31 8 249.9 25.2
195 8 8 0 39.582 79.164 0.414 3.31 4 245.3 12.1
196 8 2 8 40.296 80.592 0.42 3.22 16 2.0 0.0
197 10 4 4 40.314 80.629 0.42 3.22 16 2.5 0.0
198 3 2 11 40.643 81.286 0.423 3.18 16 137.2 14.6
199 5 3 10 40.651 81.301 0.423 3.18 16 181.6 25.5
200 7 2 9 40.658 81.316 0.423 3.18 16 73.7 4.2
201 7 6 7 40.67 81.34 0.423 3.17 16 226.2 39.6
202 9 2 7 40.67 81.34 0.423 3.17 16 66.3 3.4
203 7 7 6 40.675 81.35 0.423 3.17 8 220.7 18.8
204 10 3 5 40.679 81.358 0.423 3.17 16 181.6 25.5
205 10 5 3 40.685 81.37 0.423 3.17 16 181.5 25.5
206 11 2 3 40.685 81.37 0.423 3.17 16 136.8 14.5
207 9 7 2 40.687 81.374 0.423 3.17 16 68.2 3.6
208 11 3 2 40.687 81.374 0.423 3.17 16 135.6 14.2
209 6 0 10 41.018 82.036 0.426 3.14 8 69.0 1.8
210 6 6 8 41.032 82.063 0.426 3.13 8 76.6 2.2
211 8 6 6 41.042 82.084 0.426 3.13 16 77.7 4.6
212 10 0 6 41.042 82.084 0.426 3.13 8 69.8 1.9
213 10 6 0 41.056 82.111 0.426 3.13 8 75.0 2.1
214 4 1 11 41.377 82.754 0.429 3.1 16 88.3 5.9
215 7 5 8 41.398 82.797 0.429 3.1 16 89.5 6.1
216 8 5 7 41.404 82.808 0.429 3.1 16 92.7 6.5
217 8 7 5 41.413 82.826 0.429 3.09 16 90.8 6.2
218 11 1 4 41.416 82.832 0.429 3.09 16 86.5 5.6
219 11 4 1 41.422 82.844 0.429 3.09 16 85.3 5.5
220 6 2 10 41.751 83.502 0.432 3.06 16 0.7 0.0
221 10 2 6 41.775 83.55 0.432 3.06 16 1.5 0.0
222 10 6 2 41.787 83.574 0.433 3.06 16 3.5 0.0
223 6 5 9 42.124 84.247 0.435 3.03 16 94.8 6.6
224 9 5 6 42.14 84.281 0.436 3.03 16 99.7 7.3
225 9 6 5 42.144 84.289 0.436 3.03 16 93.4 6.4
226 0 0 12 42.465 84.93 0.438 3.0 2 237.7 5.2
227 8 4 8 42.495 84.99 0.438 2.99 16 205.9 31.0
228 8 8 4 42.513 85.026 0.439 2.99 8 202.7 15.0
229 12 0 0 42.519 85.038 0.439 2.99 4 229.1 9.6
230 4 3 11 42.838 85.677 0.441 2.97 16 29.3 0.6
231 7 4 9 42.853 85.707 0.441 2.97 16 41.4 1.2
232 8 1 9 42.853 85.707 0.441 2.97 16 36.6 1.0
233 9 1 8 42.86 85.719 0.442 2.96 16 38.3 1.1
234 9 4 7 42.865 85.73 0.442 2.96 16 42.4 1.3
235 9 7 4 42.878 85.755 0.442 2.96 16 40.8 1.2
236 11 3 4 42.878 85.755 0.442 2.96 16 27.9 0.6
237 11 4 3 42.88 85.76 0.442 2.96 16 28.9 0.6
238 9 8 1 42.883 85.766 0.442 2.96 16 35.9 0.9
239 12 1 1 42.883 85.766 0.442 2.96 16 4.1 0.0
240 2 0 12 43.194 86.388 0.444 2.94 8 86.8 2.7
241 12 0 2 43.246 86.493 0.445 2.94 8 85.5 2.6
242 12 2 0 43.248 86.496 0.445 2.94 8 91.4 3.0
243 5 2 11 43.567 87.134 0.447 2.91 16 141.7 14.3
244 5 5 10 43.575 87.149 0.447 2.91 8 246.4 21.6
245 7 1 10 43.575 87.149 0.447 2.91 16 152.6 16.5
246 10 1 7 43.594 87.187 0.448 2.91 16 157.7 17.7
247 10 5 5 43.602 87.205 0.448 2.91 16 248.4 43.8
248 11 2 5 43.602 87.205 0.448 2.91 16 143.7 14.7
249 11 5 2 43.61 87.221 0.448 2.91 16 140.6 14.0
250 10 7 1 43.611 87.223 0.448 2.91 16 157.4 17.6
251 2 2 12 43.922 87.844 0.45 2.89 8 25.7 0.2
252 6 4 10 43.938 87.877 0.45 2.89 16 39.7 1.1
253 10 4 6 43.962 87.924 0.451 2.89 16 37.5 1.0
254 10 6 4 43.97 87.939 0.451 2.89 16 43.9 1.4
255 12 2 2 43.974 87.948 0.451 2.89 16 26.3 0.5
256 3 1 12 44.286 88.571 0.453 2.87 16 42.0 1.2
257 8 3 9 44.309 88.618 0.453 2.87 16 26.1 0.5
258 9 3 8 44.315 88.631 0.453 2.87 16 23.6 0.4
259 9 8 3 44.336 88.672 0.454 2.86 16 26.3 0.5
260 12 1 3 44.336 88.672 0.454 2.86 16 42.8 1.3
261 12 3 1 44.339 88.678 0.454 2.86 16 32.9 0.8
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 2 1 1 7.928 15.856 5.58456 129.2 2.8 2.8 5.6
2 2 0 2 9.161 18.323 4.83802 91.9 2.0 2.0 5.6
3 3 1 2 12.161 24.323 3.6564 1769.2 38.1 38.1 5.6
4 4 0 0 13.019 26.038 3.41925 4648.9 100.0 100.0 5.6
5 4 2 0 14.588 29.176 3.05827 78.2 1.7 1.7 5.6
6 3 2 3 15.311 30.621 2.91717 2071.8 44.6 44.4 5.6
7 4 1 3 16.683 33.365 2.68323 192.5 4.1 4.1 5.7
8 5 2 1 17.967 35.933 2.49715 231.8 5.0 4.9 5.7
9 4 0 4 18.568 37.136 2.41901 1337.3 28.8 28.5 5.7
10 6 1 1 20.314 40.628 2.21876 615.8 13.2 13.1 5.7
11 3 1 6 22.437 44.874 2.01818 303.1 6.5 6.4 5.7
12 4 4 4 22.958 45.916 1.97478 172.6 3.7 3.6 5.7
13 6 4 0 23.962 47.923 1.89666 84.9 1.8 1.8 5.7
14 7 2 1 24.447 48.894 1.86124 753.8 16.2 15.9 5.7
15 7 3 2 26.323 52.646 1.7371 873.9 18.8 18.3 5.8
16 0 0 8 26.75 53.499 1.71137 84.9 1.8 1.8 5.8
17 8 0 0 26.779 53.559 1.70963 161.4 3.5 3.4 5.8
18 4 1 7 27.206 54.412 1.6848 78.2 1.7 1.6 5.8
19 5 3 6 28.096 56.192 1.63557 116.9 2.5 2.4 5.8
20 8 1 3 28.974 57.949 1.59012 71.0 1.5 1.5 5.8
21 7 5 2 29.826 59.653 1.5487 171.0 3.7 3.5 5.8
22 4 0 8 30.22 60.44 1.53039 301.9 6.5 6.3 5.8
23 6 5 5 31.475 62.95 1.47527 164.7 3.5 3.4 5.9
24 7 6 3 33.092 66.184 1.41081 241.2 5.2 5.0 5.9
25 8 4 4 33.485 66.97 1.39614 107.7 2.3 2.2 5.9
26 7 2 7 34.647 69.294 1.35489 312.9 6.7 6.4 5.9
27 3 1 10 36.166 72.333 1.30526 148.0 3.2 3.0 5.9
28 10 1 3 36.202 72.404 1.30416 132.6 2.9 2.7 5.9
29 8 7 1 36.965 73.929 1.28098 58.7 1.3 1.2 6.0
30 10 3 3 37.715 75.43 1.25917 51.0 1.1 1.0 6.0
31 10 1 5 39.202 78.404 1.21869 157.3 3.4 3.2 6.0
32 10 5 3 40.685 81.37 1.18159 189.6 4.1 3.8 6.1
33 8 4 8 42.495 84.99 1.14027 60.7 1.3 1.2 6.1
34 10 5 5 43.602 87.205 1.11691 160.1 3.4 3.1 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)
|