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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ONEILLITE
1, t-eudialyte, DF
Na(15)[Ca(5.6)Mn(0.4)(REE,Y)(0.3)](Fe,Mn)(2)Zr(3)Si(25)O(73)[OH,H(2),Cl](3)
Hexagonal R 3(-)m Z = 3
R =0.031 NR =1934
19 .5 .1904
Ref.Str.:
Johnsen O., Grice J.D. (1999)
* Canad. Mineral., 37, 865-892
Reserv:
N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 14.2646 alpha = 90.0
b = 14.2646 beta = 90.0
c = 30.186 gamma = 120.0
Unit cell volume (cub. angs.) = 5319.31
Molar volume ( cub.cm/mol.) = 1068.01
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.0 0.7398 0.5 0.0 Ca = 0.89, Mn = 0.07, Y = 0.05
2 0.0 0.5 0.5 0.0 Fe = 0.59, Mn = 0.04
3 0.9499 0.4749 0.4973 0.0 Mn = 0.09, Mn = 0.0
4 0.0 0.0 0.1272 0.0 Si = 0.56, Nd = 0.11
5 0.0 0.0 0.0789 0.0 Si = 0.56, Nd = 0.11
6 0.2211 0.7789 0.0142 0.0 Na = 0.32, Na = 0.0
7 0.2468 0.7532 0.9998 0.0 Na = 0.33, Na = 0.0
8 0.5607 0.4393 0.1181 0.0 Na = 0.58, K = 0.03, Ca = 0.03
9 0.9234 0.0766 0.0108 0.0 Na = 0.33, Na = 0.0
10 0.5 0.5 0.0 0.0 Zr = 1.00
11 0.4036 0.5964 0.0845 0.0 Si = 1.00
12 0.1249 0.8751 0.0912 0.0 Si = 0.5 , Si = 0.0
13 0.1009 0.8991 0.104 0.0 Si = 0.5 , Si = 0.0
14 0.3397 0.2761 0.0698 0.0 Si = 1.00
15 0.2715 0.7285 0.0887 0.0 O = 1.00
16 0.4474 0.5526 0.1228 0.0 O = 1.00
17 0.4278 0.5722 0.0352 0.0 O = 1.00
18 0.233 0.2877 0.0596 0.0 O = 0.5 , O = 0.0
19 0.2084 0.2385 0.065 0.0 O = 0.5 , O = 0.0
20 0.153 0.847 0.1381 0.0 O = 1.00
21 0.0601 0.9399 0.0934 0.0 O = 1.00
22 0.4369 0.3645 0.0405 0.0 O = 1.00
23 0.3667 0.2886 0.1218 0.0 O = 1.00
24 0.8434 0.1566 0.0518 0.0 O = 1.00
25 0.0618 0.9382 0.8391 0.0 O = 0.05, O = 0.0
26 0.8817 0.4409 0.4965 0.0 O = 0.1 , O = 0.0
27 0.0 0.0 0.0269 0.0 O = 0.06, O = 0.0
28 0.0 0.0 0.741 0.0 Cl = 0.03, Cl = 0.0
29 0.0206 0.9794 0.7003 0.0 Cl = 0.08, Cl = 0.0
30 0.0509 0.9491 0.8068 0.0 Cl = 0.04, Cl = 0.0
31 0.0 0.0 0.789 0.0 Cl = 0.08, Cl = 0.0
32 0.0 0.0 0.6877 0.0 Cl = 0.05, Cl = 0.0
33 0.0398 0.9602 0.778 0.0 Cl = 0.06, Cl = 0.0
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.0 0.7398 0.5
2 2 0.0 0.5 0.5
3 3 0.9499 0.4749 0.4973
4 4 0.0 0.0 0.1272
5 5 0.0 0.0 0.0789
6 6 0.2211 0.7789 0.0142
7 7 0.2468 0.7532 0.9998
8 8 0.5607 0.4393 0.1181
9 9 0.9234 0.0766 0.0108
10 10 0.5 0.5 0.0
11 11 0.4036 0.5964 0.0845
12 12 0.1249 0.8751 0.0912
13 13 0.1009 0.8991 0.104
14 14 0.3397 0.2761 0.0698
15 15 0.2715 0.7285 0.0887
16 16 0.4474 0.5526 0.1228
17 17 0.4278 0.5722 0.0352
18 18 0.233 0.2877 0.0596
19 19 0.2084 0.2385 0.065
20 20 0.153 0.847 0.1381
21 21 0.0601 0.9399 0.0934
22 22 0.4369 0.3645 0.0405
23 23 0.3667 0.2886 0.1218
24 24 0.8434 0.1566 0.0518
25 25 0.0618 0.9382 0.8391
26 26 0.8817 0.4409 0.4965
27 27 0.0 0.0 0.0269
28 28 0.0 0.0 0.741
29 29 0.0206 0.9794 0.7003
30 30 0.0509 0.9491 0.8068
31 31 0.0 0.0 0.789
32 32 0.0 0.0 0.6877
33 33 0.0398 0.9602 0.778
34 1 0.2602 0.2602 0.5
35 1 0.7398 0.0 0.5
36 2 0.5 0.5 0.5
37 2 0.5 0.0 0.5
38 3 0.5251 0.475 0.4973
39 3 0.525 0.0501 0.4973
40 6 0.2211 0.4422 0.0142
41 6 0.5578 0.7789 0.0142
42 7 0.2468 0.4936 0.9998
43 7 0.5064 0.7532 0.9998
44 8 0.5607 0.1214 0.1181
45 8 0.8786 0.4393 0.1181
46 9 0.9234 0.8468 0.0108
47 9 0.1532 0.0766 0.0108
48 10 0.5 0.0 0.0
49 10 0.0 0.5 0.0
50 11 0.4036 0.8072 0.0845
51 11 0.1928 0.5964 0.0845
52 12 0.1249 0.2498 0.0912
53 12 0.7502 0.8751 0.0912
54 13 0.1009 0.2018 0.104
55 13 0.7982 0.8991 0.104
56 14 0.7239 0.0636 0.0698
57 14 0.9364 0.6603 0.0698
58 15 0.2715 0.543 0.0887
59 15 0.457 0.7285 0.0887
60 16 0.4474 0.8948 0.1228
61 16 0.1052 0.5526 0.1228
62 17 0.4278 0.8556 0.0352
63 17 0.1444 0.5722 0.0352
64 18 0.7123 0.9453 0.0596
65 18 0.0547 0.767 0.0596
66 19 0.7615 0.9699 0.065
67 19 0.0301 0.7916 0.065
68 20 0.153 0.306 0.1381
69 20 0.694 0.847 0.1381
70 21 0.0601 0.1202 0.0934
71 21 0.8798 0.9399 0.0934
72 22 0.6355 0.0724 0.0405
73 22 0.9276 0.5631 0.0405
74 23 0.7114 0.0781 0.1218
75 23 0.9219 0.6333 0.1218
76 24 0.8434 0.6868 0.0518
77 24 0.3132 0.1566 0.0518
78 25 0.0618 0.1236 0.8391
79 25 0.8764 0.9382 0.8391
80 26 0.5591 0.4408 0.4965
81 26 0.5592 0.1183 0.4965
82 29 0.0206 0.0412 0.7003
83 29 0.9588 0.9794 0.7003
84 30 0.0509 0.1018 0.8068
85 30 0.8982 0.9491 0.8068
86 33 0.0398 0.0796 0.778
87 33 0.9204 0.9602 0.778
88 1 0.9269 0.5935 0.8333
89 1 0.0731 0.6667 0.1667
90 2 0.1667 0.8333 0.8333
91 2 0.8333 0.6667 0.1667
92 3 0.1918 0.8083 0.8306
93 3 0.8583 0.7168 0.164
94 4 0.6667 0.3333 0.4605
95 4 0.3333 0.6667 0.7939
96 5 0.6667 0.3333 0.4122
97 5 0.3333 0.6667 0.7456
98 6 0.8878 0.7755 0.3475
99 6 0.8911 0.4456 0.6809
100 7 0.9135 0.8269 0.3331
101 7 0.8397 0.4199 0.6665
102 8 0.2274 0.4547 0.4514
103 8 0.2119 0.106 0.7848
104 9 0.5901 0.1801 0.3441
105 9 0.4865 0.7433 0.6775
106 10 0.1667 0.3333 0.3333
107 10 0.3333 0.1667 0.6667
108 11 0.0703 0.1405 0.4178
109 11 0.5261 0.2631 0.7512
110 12 0.7916 0.5831 0.4245
111 12 0.0835 0.5418 0.7579
112 13 0.7676 0.5351 0.4373
113 13 0.1315 0.5658 0.7707
114 14 0.3906 0.3969 0.4031
115 14 0.2697 0.327 0.7365
116 15 0.9382 0.8763 0.422
117 15 0.7903 0.3952 0.7554
118 16 0.1141 0.2281 0.4561
119 16 0.4385 0.2193 0.7895
120 17 0.0945 0.1889 0.3685
121 17 0.4777 0.2389 0.7019
122 18 0.379 0.2786 0.3929
123 18 0.388 0.4337 0.7263
124 19 0.4282 0.3032 0.3983
125 19 0.3634 0.4583 0.7317
126 20 0.8197 0.6393 0.4714
127 20 0.0273 0.5137 0.8048
128 21 0.7268 0.4535 0.4267
129 21 0.2131 0.6066 0.7601
130 22 0.3022 0.4057 0.3738
131 22 0.2609 0.2298 0.7072
132 23 0.3781 0.4114 0.4551
133 23 0.2552 0.3 0.7885
134 24 0.5101 0.0201 0.3851
135 24 0.6465 0.8233 0.7185
136 25 0.7285 0.4569 0.1724
137 25 0.2097 0.6049 0.5058
138 26 0.2258 0.7741 0.8298
139 26 0.8925 0.785 0.1632
140 27 0.6667 0.3333 0.3602
141 27 0.3333 0.6667 0.6936
142 28 0.6667 0.3333 0.0743
143 28 0.3333 0.6667 0.4077
144 29 0.6873 0.3745 0.0336
145 29 0.2921 0.6461 0.367
146 30 0.7176 0.4351 0.1401
147 30 0.2315 0.6158 0.4735
148 31 0.6667 0.3333 0.1223
149 31 0.3333 0.6667 0.4557
150 32 0.6667 0.3333 0.021
151 32 0.3333 0.6667 0.3544
152 33 0.7065 0.4129 0.1113
153 33 0.2537 0.6269 0.4447
154 1 0.4065 0.3333 0.8333
155 1 0.3333 0.4065 0.1667
156 1 0.6667 0.0731 0.8333
157 1 0.5935 0.9269 0.1667
158 2 0.1667 0.3333 0.8333
159 2 0.3333 0.1667 0.1667
160 2 0.6667 0.8333 0.8333
161 2 0.8333 0.1666 0.1667
162 3 0.1917 0.3834 0.8306
163 3 0.2832 0.1416 0.164
164 3 0.6166 0.8082 0.8306
165 3 0.8584 0.1417 0.164
166 6 0.2245 0.1122 0.3475
167 6 0.5544 0.4456 0.6809
168 6 0.8878 0.1122 0.3475
169 6 0.5544 0.1088 0.6809
170 7 0.1731 0.0865 0.3331
171 7 0.5801 0.4199 0.6665
172 7 0.9135 0.0865 0.3331
173 7 0.5801 0.1602 0.6665
174 8 0.5453 0.7726 0.4514
175 8 0.894 0.106 0.7848
176 8 0.2274 0.7726 0.4514
177 8 0.894 0.7881 0.7848
178 9 0.8199 0.4099 0.3441
179 9 0.2567 0.7433 0.6775
180 9 0.5901 0.4099 0.3441
181 9 0.2567 0.5134 0.6775
182 10 0.6667 0.8333 0.3333
183 10 0.8333 0.1667 0.6667
184 10 0.1667 0.8333 0.3333
185 10 0.8333 0.6667 0.6667
186 11 0.8595 0.9297 0.4178
187 11 0.7369 0.2631 0.7512
188 11 0.0703 0.9297 0.4178
189 11 0.7369 0.4738 0.7512
190 12 0.4169 0.2084 0.4245
191 12 0.4582 0.5418 0.7579
192 12 0.7916 0.2084 0.4245
193 12 0.4582 0.9164 0.7579
194 13 0.4649 0.2324 0.4373
195 13 0.4342 0.5658 0.7707
196 13 0.7676 0.2324 0.4373
197 13 0.4342 0.8684 0.7707
198 14 0.6031 0.9936 0.4031
199 14 0.673 0.9428 0.7365
200 14 0.0064 0.6094 0.4031
201 14 0.0572 0.7303 0.7365
202 15 0.1237 0.0618 0.422
203 15 0.6048 0.3952 0.7554
204 15 0.9382 0.0618 0.422
205 15 0.6048 0.2096 0.7554
206 16 0.7719 0.8859 0.4561
207 16 0.7807 0.2193 0.7895
208 16 0.1141 0.8859 0.4561
209 16 0.7807 0.5614 0.7895
210 17 0.8111 0.9055 0.3685
211 17 0.7611 0.2389 0.7019
212 17 0.0945 0.9055 0.3685
213 17 0.7611 0.5222 0.7019
214 18 0.7214 0.1003 0.3929
215 18 0.5663 0.9544 0.7263
216 18 0.8997 0.621 0.3929
217 18 0.0456 0.6119 0.7263
218 19 0.6968 0.1249 0.3983
219 19 0.5417 0.9052 0.7317
220 19 0.8751 0.5718 0.3983
221 19 0.0948 0.6366 0.7317
222 20 0.3607 0.1803 0.4714
223 20 0.4863 0.5137 0.8048
224 20 0.8197 0.1803 0.4714
225 20 0.4863 0.9726 0.8048
226 21 0.5465 0.2732 0.4267
227 21 0.3934 0.6066 0.7601
228 21 0.7268 0.2732 0.4267
229 21 0.3934 0.7868 0.7601
230 22 0.5943 0.8964 0.3738
231 22 0.7702 0.0312 0.7072
232 22 0.1036 0.6978 0.3738
233 22 0.9688 0.7391 0.7072
234 23 0.5886 0.9666 0.4551
235 23 0.7 0.9553 0.7885
236 23 0.0334 0.6219 0.4551
237 23 0.0447 0.7448 0.7885
238 24 0.9799 0.4899 0.3851
239 24 0.1767 0.8233 0.7185
240 24 0.5101 0.4899 0.3851
241 24 0.1767 0.3534 0.7185
242 25 0.5431 0.2715 0.1724
243 25 0.3951 0.6049 0.5058
244 25 0.7285 0.2715 0.1724
245 25 0.3951 0.7903 0.5058
246 26 0.2259 0.4516 0.8298
247 26 0.215 0.1076 0.1632
248 26 0.5484 0.7742 0.8298
249 26 0.8924 0.1074 0.1632
250 29 0.6255 0.3127 0.0336
251 29 0.3539 0.6461 0.367
252 29 0.6873 0.3127 0.0336
253 29 0.3539 0.7078 0.367
254 30 0.5649 0.2824 0.1401
255 30 0.3842 0.6158 0.4735
256 30 0.7176 0.2824 0.1401
257 30 0.3842 0.7685 0.4735
258 33 0.5871 0.2935 0.1113
259 33 0.3731 0.6269 0.4447
260 33 0.7065 0.2935 0.1113
261 33 0.3731 0.7462 0.4447
262 1 0.0 0.2602 0.5
263 14 0.3397 0.0636 0.0698
264 18 0.233 0.9453 0.0596
265 19 0.2084 0.9699 0.065
266 22 0.4369 0.0724 0.0405
267 23 0.3667 0.0781 0.1218
268 1 0.2602 0.0 0.5
269 1 0.7398 0.7398 0.5
270 14 0.7239 0.6603 0.0698
271 14 0.9364 0.2761 0.0698
272 18 0.7123 0.767 0.0596
273 18 0.0547 0.2877 0.0596
274 19 0.7615 0.7916 0.065
275 19 0.0301 0.2385 0.065
276 22 0.6355 0.5631 0.0405
277 22 0.9276 0.3645 0.0405
278 23 0.7114 0.6333 0.1218
279 23 0.9219 0.2886 0.1218
280 1 0.9269 0.3333 0.8333
281 1 0.0731 0.4065 0.1667
282 14 0.3906 0.9936 0.4031
283 14 0.2697 0.9428 0.7365
284 18 0.379 0.1003 0.3929
285 18 0.388 0.9544 0.7263
286 19 0.4282 0.1249 0.3983
287 19 0.3634 0.9052 0.7317
288 22 0.3022 0.8964 0.3738
289 22 0.2609 0.0312 0.7072
290 23 0.3781 0.9666 0.4551
291 23 0.2552 0.9553 0.7885
292 1 0.4065 0.0731 0.8333
293 1 0.3333 0.9269 0.1667
294 1 0.6667 0.5935 0.8333
295 1 0.5935 0.6667 0.1667
296 14 0.6031 0.6094 0.4031
297 14 0.673 0.7303 0.7365
298 14 0.0064 0.3969 0.4031
299 14 0.0572 0.327 0.7365
300 18 0.7214 0.621 0.3929
301 18 0.5663 0.612 0.7263
302 18 0.8997 0.2786 0.3929
303 18 0.0456 0.4337 0.7263
304 19 0.6968 0.5718 0.3983
305 19 0.5417 0.6366 0.7317
306 19 0.8751 0.3032 0.3983
307 19 0.0948 0.4583 0.7317
308 22 0.5943 0.6978 0.3738
309 22 0.7702 0.7391 0.7072
310 22 0.1036 0.4057 0.3738
311 22 0.9688 0.2298 0.7072
312 23 0.5886 0.6219 0.4551
313 23 0.7 0.7448 0.7885
314 23 0.0334 0.4114 0.4551
315 23 0.0447 0.3 0.7885
316 3 0.0501 0.5251 0.5027
317 4 0.0 0.0 0.8728
318 5 0.0 0.0 0.9211
319 6 0.7789 0.2211 0.9858
320 7 0.7532 0.2468 0.0002
321 8 0.4393 0.5607 0.8819
322 9 0.0766 0.9234 0.9892
323 11 0.5964 0.4036 0.9155
324 12 0.8751 0.1249 0.9088
325 13 0.8991 0.1009 0.896
326 14 0.6603 0.7239 0.9302
327 15 0.7285 0.2715 0.9113
328 16 0.5526 0.4474 0.8772
329 17 0.5722 0.4278 0.9648
330 18 0.767 0.7123 0.9404
331 19 0.7916 0.7615 0.935
332 20 0.847 0.153 0.8619
333 21 0.9399 0.0601 0.9066
334 22 0.5631 0.6355 0.9595
335 23 0.6333 0.7114 0.8782
336 24 0.1566 0.8434 0.9482
337 25 0.9382 0.0618 0.1609
338 26 0.1183 0.5591 0.5035
339 27 0.0 0.0 0.9731
340 28 0.0 0.0 0.259
341 29 0.9794 0.0206 0.2997
342 30 0.9491 0.0509 0.1932
343 31 0.0 0.0 0.211
344 32 0.0 0.0 0.3123
345 33 0.9602 0.0398 0.222
346 3 0.4749 0.525 0.5027
347 3 0.475 0.9499 0.5027
348 6 0.7789 0.5578 0.9858
349 6 0.4422 0.2211 0.9858
350 7 0.7532 0.5064 0.0002
351 7 0.4936 0.2468 0.0002
352 8 0.4393 0.8786 0.8819
353 8 0.1214 0.5607 0.8819
354 9 0.0766 0.1532 0.9892
355 9 0.8468 0.9234 0.9892
356 11 0.5964 0.1928 0.9155
357 11 0.8072 0.4036 0.9155
358 12 0.8751 0.7502 0.9088
359 12 0.2498 0.1249 0.9088
360 13 0.8991 0.7982 0.896
361 13 0.2018 0.1009 0.896
362 14 0.2761 0.9364 0.9302
363 14 0.0636 0.3397 0.9302
364 15 0.7285 0.457 0.9113
365 15 0.543 0.2715 0.9113
366 16 0.5526 0.1052 0.8772
367 16 0.8948 0.4474 0.8772
368 17 0.5722 0.1444 0.9648
369 17 0.8556 0.4278 0.9648
370 18 0.2877 0.0547 0.9404
371 18 0.9453 0.233 0.9404
372 19 0.2385 0.0301 0.935
373 19 0.9699 0.2084 0.935
374 20 0.847 0.694 0.8619
375 20 0.306 0.153 0.8619
376 21 0.9399 0.8798 0.9066
377 21 0.1202 0.0601 0.9066
378 22 0.3645 0.9276 0.9595
379 22 0.0724 0.4369 0.9595
380 23 0.2886 0.9219 0.8782
381 23 0.0781 0.3667 0.8782
382 24 0.1566 0.3132 0.9482
383 24 0.6868 0.8434 0.9482
384 25 0.9382 0.8764 0.1609
385 25 0.1236 0.0618 0.1609
386 26 0.4409 0.5592 0.5035
387 26 0.4408 0.8817 0.5035
388 29 0.9794 0.9588 0.2997
389 29 0.0412 0.0206 0.2997
390 30 0.9491 0.8982 0.1932
391 30 0.1018 0.0509 0.1932
392 33 0.9602 0.9204 0.222
393 33 0.0796 0.0398 0.222
394 3 0.8082 0.1917 0.1694
395 3 0.1417 0.2832 0.836
396 4 0.3333 0.6667 0.5395
397 4 0.6667 0.3333 0.2061
398 5 0.3333 0.6667 0.5878
399 5 0.6667 0.3333 0.2544
400 6 0.1122 0.2245 0.6525
401 6 0.1089 0.5544 0.3191
402 7 0.0865 0.1731 0.6669
403 7 0.1603 0.5801 0.3335
404 8 0.7726 0.5453 0.5486
405 8 0.7881 0.894 0.2152
406 9 0.4099 0.8199 0.6559
407 9 0.5135 0.2567 0.3225
408 11 0.9297 0.8595 0.5822
409 11 0.4739 0.7369 0.2488
410 12 0.2084 0.4169 0.5755
411 12 0.9165 0.4582 0.2421
412 13 0.2324 0.4649 0.5627
413 13 0.8685 0.4342 0.2293
414 14 0.6094 0.6031 0.5969
415 14 0.7303 0.673 0.2635
416 15 0.0618 0.1237 0.578
417 15 0.2097 0.6048 0.2446
418 16 0.8859 0.7719 0.5439
419 16 0.5615 0.7807 0.2105
420 17 0.9055 0.8111 0.6315
421 17 0.5223 0.7611 0.2981
422 18 0.621 0.7214 0.6071
423 18 0.612 0.5663 0.2737
424 19 0.5718 0.6968 0.6017
425 19 0.6366 0.5417 0.2683
426 20 0.1803 0.3607 0.5286
427 20 0.9727 0.4863 0.1952
428 21 0.2732 0.5465 0.5733
429 21 0.7869 0.3934 0.2399
430 22 0.6978 0.5943 0.6262
431 22 0.7391 0.7702 0.2928
432 23 0.6219 0.5886 0.5449
433 23 0.7448 0.7 0.2115
434 24 0.4899 0.9799 0.6149
435 24 0.3535 0.1767 0.2815
436 25 0.2715 0.5431 0.8276
437 25 0.7903 0.3951 0.4942
438 26 0.7742 0.2259 0.1702
439 26 0.1075 0.215 0.8368
440 27 0.3333 0.6667 0.6398
441 27 0.6667 0.3333 0.3064
442 28 0.3333 0.6667 0.9257
443 28 0.6667 0.3333 0.5923
444 29 0.3127 0.6255 0.9664
445 29 0.7079 0.3539 0.633
446 30 0.2824 0.5649 0.8599
447 30 0.7685 0.3842 0.5265
448 31 0.3333 0.6667 0.8777
449 31 0.6667 0.3333 0.5443
450 32 0.3333 0.6667 0.979
451 32 0.6667 0.3333 0.6456
452 33 0.2935 0.5871 0.8887
453 33 0.7463 0.3731 0.5553
454 3 0.8083 0.6166 0.1694
455 3 0.7168 0.8584 0.836
456 3 0.3834 0.1918 0.1694
457 3 0.1416 0.8583 0.836
458 6 0.7755 0.8878 0.6525
459 6 0.4456 0.5544 0.3191
460 6 0.1122 0.8878 0.6525
461 6 0.4456 0.8912 0.3191
462 7 0.8269 0.9135 0.6669
463 7 0.4199 0.5801 0.3335
464 7 0.0865 0.9135 0.6669
465 7 0.4199 0.8398 0.3335
466 8 0.4547 0.2274 0.5486
467 8 0.106 0.894 0.2152
468 8 0.7726 0.2274 0.5486
469 8 0.106 0.2119 0.2152
470 9 0.1801 0.5901 0.6559
471 9 0.7433 0.2567 0.3225
472 9 0.4099 0.5901 0.6559
473 9 0.7433 0.4866 0.3225
474 11 0.1405 0.0703 0.5822
475 11 0.2631 0.7369 0.2488
476 11 0.9297 0.0703 0.5822
477 11 0.2631 0.5262 0.2488
478 12 0.5831 0.7916 0.5755
479 12 0.5418 0.4582 0.2421
480 12 0.2084 0.7916 0.5755
481 12 0.5418 0.0836 0.2421
482 13 0.5351 0.7676 0.5627
483 13 0.5658 0.4342 0.2293
484 13 0.2324 0.7676 0.5627
485 13 0.5658 0.1316 0.2293
486 14 0.3969 0.0064 0.5969
487 14 0.327 0.0572 0.2635
488 14 0.9936 0.3906 0.5969
489 14 0.9428 0.2697 0.2635
490 15 0.8763 0.9382 0.578
491 15 0.3952 0.6048 0.2446
492 15 0.0618 0.9382 0.578
493 15 0.3952 0.7904 0.2446
494 16 0.2281 0.1141 0.5439
495 16 0.2193 0.7807 0.2105
496 16 0.8859 0.1141 0.5439
497 16 0.2193 0.4386 0.2105
498 17 0.1889 0.0945 0.6315
499 17 0.2389 0.7611 0.2981
500 17 0.9055 0.0945 0.6315
501 17 0.2389 0.4778 0.2981
502 18 0.2786 0.8997 0.6071
503 18 0.4337 0.0456 0.2737
504 18 0.1003 0.379 0.6071
505 18 0.9544 0.3881 0.2737
506 19 0.3032 0.8751 0.6017
507 19 0.4583 0.0948 0.2683
508 19 0.1249 0.4282 0.6017
509 19 0.9052 0.3634 0.2683
510 20 0.6393 0.8197 0.5286
511 20 0.5137 0.4863 0.1952
512 20 0.1803 0.8197 0.5286
513 20 0.5137 0.0274 0.1952
514 21 0.4535 0.7268 0.5733
515 21 0.6066 0.3934 0.2399
516 21 0.2732 0.7268 0.5733
517 21 0.6066 0.2132 0.2399
518 22 0.4057 0.1036 0.6262
519 22 0.2298 0.9688 0.2928
520 22 0.8964 0.3022 0.6262
521 22 0.0312 0.2609 0.2928
522 23 0.4114 0.0334 0.5449
523 23 0.3 0.0447 0.2115
524 23 0.9666 0.3781 0.5449
525 23 0.9553 0.2552 0.2115
526 24 0.0201 0.5101 0.6149
527 24 0.8233 0.1767 0.2815
528 24 0.4899 0.5101 0.6149
529 24 0.8233 0.6466 0.2815
530 25 0.4569 0.7285 0.8276
531 25 0.6049 0.3951 0.4942
532 25 0.2715 0.7285 0.8276
533 25 0.6049 0.2097 0.4942
534 26 0.7741 0.5484 0.1702
535 26 0.785 0.8924 0.8368
536 26 0.4516 0.2258 0.1702
537 26 0.1076 0.8926 0.8368
538 29 0.3745 0.6873 0.9664
539 29 0.6461 0.3539 0.633
540 29 0.3127 0.6873 0.9664
541 29 0.6461 0.2922 0.633
542 30 0.4351 0.7176 0.8599
543 30 0.6158 0.3842 0.5265
544 30 0.2824 0.7176 0.8599
545 30 0.6158 0.2315 0.5265
546 33 0.4129 0.7065 0.8887
547 33 0.6269 0.3731 0.5553
548 33 0.2935 0.7065 0.8887
549 33 0.6269 0.2538 0.5553
550 14 0.6603 0.9364 0.9302
551 18 0.767 0.0547 0.9404
552 19 0.7916 0.0301 0.935
553 22 0.5631 0.9276 0.9595
554 23 0.6333 0.9219 0.8782
555 14 0.2761 0.3397 0.9302
556 14 0.0636 0.7239 0.9302
557 18 0.2877 0.233 0.9404
558 18 0.9453 0.7123 0.9404
559 19 0.2385 0.2084 0.935
560 19 0.9699 0.7615 0.935
561 22 0.3645 0.4369 0.9595
562 22 0.0724 0.6355 0.9595
563 23 0.2886 0.3667 0.8782
564 23 0.0781 0.7114 0.8782
565 14 0.6094 0.0064 0.5969
566 14 0.7303 0.0572 0.2635
567 18 0.621 0.8997 0.6071
568 18 0.612 0.0456 0.2737
569 19 0.5718 0.8751 0.6017
570 19 0.6366 0.0948 0.2683
571 22 0.6978 0.1036 0.6262
572 22 0.7391 0.9688 0.2928
573 23 0.6219 0.0334 0.5449
574 23 0.7448 0.0447 0.2115
575 14 0.3969 0.3906 0.5969
576 14 0.327 0.2697 0.2635
577 14 0.9936 0.6031 0.5969
578 14 0.9428 0.673 0.2635
579 18 0.2786 0.379 0.6071
580 18 0.4337 0.388 0.2737
581 18 0.1003 0.7214 0.6071
582 18 0.9544 0.5663 0.2737
583 19 0.3032 0.4282 0.6017
584 19 0.4583 0.3634 0.2683
585 19 0.1249 0.6968 0.6017
586 19 0.9052 0.5417 0.2683
587 22 0.4057 0.3022 0.6262
588 22 0.2298 0.2609 0.2928
589 22 0.8964 0.5943 0.6262
590 22 0.0312 0.7702 0.2928
591 23 0.4114 0.3781 0.5449
592 23 0.3 0.2552 0.2115
593 23 0.9666 0.5886 0.5449
594 23 0.9553 0.7 0.2115
X-ray density (g/cm cub.) = 2.73
MU (1/cm) = 249.328 Mass attenuation coefficient (cm**2/g) = 91.195
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Ca ,Mn ,Y 3.42 6
2.3934 20
2.314 16
2.3849 23
2.314 16
2.3935 20
2.3849 23
2 Fe ,Mn 3.264 10
1.4652 26
2.5967 25
2.9703 30
2.0637 23
2.0637 23
1.4652 26
2.5967 25
2.9703 30
2.0637 23
2.0637 23
3 Mn ,Mn 3.264 10
0.8429 26
3.22 25
2.2226 23
2.2216 23
2.0887 26
1.9742 25
2.4088 30
3.0655 33
2.0874 23
2.0884 23
4 Si ,Nd 3.36 17
1.8016 21
3.0277 27
1.8015 21
1.8015 21
2.8697 26
2.8695 26
2.8696 26
1.8347 25
2.356 30
2.5296 31
3.0259 33
1.8346 25
1.8346 25
2.3559 30
2.3559 30
3.0258 33
3.0258 33
5 Si ,Nd 3.36 14
3.2364 19
1.5481 21
1.5697 27
3.2363 19
3.2364 19
1.5479 21
1.5479 21
3.2364 19
3.2363 19
3.2364 19
2.9083 25
3.1937 27
2.9082 25
2.9082 25
6 Na ,Na 3.348 12
2.5706 15
2.6583 17
2.6583 17
2.6716 18
3.2094 19
2.6717 18
3.2095 19
2.5512 24
2.6592 22
2.9699 32
2.6853 29
2.6592 22
7 Na ,Na 3.348 11
2.752 15
2.484 17
2.484 17
2.7189 24
2.5122 22
3.0949 28
2.6337 29
2.2286 32
2.6337 29
1.9164 29
2.5123 22
8 Na ,K ,Ca 3.768 19
2.8029 16
2.8035 22
2.5185 23
2.8067 25
2.9326 28
3.5046 29
2.3634 30
2.6212 31
2.2997 33
2.8067 25
3.5046 29
2.3634 30
2.2997 33
3.6071 33
2.8036 22
2.5186 23
2.6024 20
3.0697 26
3.0709 26
9 Na ,Na 3.348 14
2.3321 24
1.954 27
3.0176 18
2.61 19
3.0321 21
3.0321 21
3.0177 18
2.61 19
3.1717 21
2.2084 27
2.9823 18
2.8219 19
2.9823 18
2.8219 19
10 Zr 3.156 6
2.0763 17
2.0739 22
2.0739 22
2.0763 17
2.0739 22
2.0739 22
11 Si 2.64 4
1.5836 16
1.6038 17
1.6467 15
1.6467 15
12 Si ,Si 2.64 6
1.5768 20
1.6024 21
1.6572 18
1.504 19
1.6572 18
1.504 19
13 Si ,Si 2.64 6
1.6482 20
1.0576 21
2.1306 18
1.7913 19
2.1306 18
1.7913 19
14 Si 2.64 5
1.6403 18
1.6769 19
1.5957 22
1.6048 23
1.6431 24
15 O 3.804 10
3.2857 20
2.6462 15
2.6462 15
2.6514 16
2.6514 16
2.6122 17
2.6122 17
3.5121 18
3.5122 18
3.6477 32
16 O 3.804 8
2.6883 17
3.6044 22
3.3426 23
2.6514 15
2.6514 15
3.6044 22
3.3425 23
2.7317 20
17 O 3.804 13
2.6883 16
3.6683 18
3.034 22
2.6122 15
2.6122 15
3.6684 18
3.0339 22
2.8318 22
2.9724 29
2.8859 32
2.9724 29
3.5211 29
2.8319 22
18 O ,O 3.804 12
3.6683 17
0.6293 19
2.6088 22
2.6718 23
3.5121 15
2.6987 20
2.6344 21
2.646 24
2.5433 18
2.62 19
3.609 24
3.6312 22
19 O ,O 3.804 12
0.6293 18
3.7871 21
2.9229 22
2.6336 23
3.4089 27
2.6798 20
2.1185 21
2.3464 24
3.529 26
2.62 18
2.5433 19
3.626 25
20 O 3.804 17
3.2857 15
2.6625 21
2.6987 18
2.6798 19
3.2175 23
3.4456 26
3.4469 26
2.6988 18
2.6798 19
3.2176 23
3.365 25
3.365 25
3.7262 30
3.7262 30
2.7317 16
3.3694 23
3.3692 23
21 O 3.804 19
3.7871 19
2.6625 20
2.4969 27
2.6344 18
2.1185 19
2.5718 21
2.5718 21
3.6066 24
3.6066 24
3.1225 26
3.1229 26
2.6344 18
2.1185 19
3.7871 19
3.6363 25
2.5339 25
2.5339 25
3.3158 30
3.3158 30
22 O 3.804 15
3.6044 16
3.034 17
2.6088 18
2.9229 19
2.6671 23
2.6061 24
3.666 28
3.5081 29
3.5696 32
3.132 29
3.5147 33
2.833 22
2.8318 17
3.6313 18
3.0295 22
23 O 3.804 15
3.3426 16
2.6718 18
2.6336 19
2.6671 22
3.2175 20
2.675 24
3.0556 25
2.7059 26
2.9246 30
3.1249 33
3.0027 23
3.559 25
3.3694 20
2.343 26
2.8315 23
24 O 3.804 13
2.646 18
2.3464 19
3.6066 21
3.6066 21
2.6061 22
2.675 23
3.5736 26
2.646 18
2.3464 19
2.6062 22
2.6751 23
3.6089 18
3.6089 18
25 O ,O 3.804 24
3.3317 28
1.0115 30
2.1491 31
1.9228 33
2.6445 25
2.6445 25
2.6044 30
2.6044 30
2.8637 33
2.8637 33
3.0559 23
3.0557 23
3.6363 21
3.626 19
3.3649 20
3.3649 20
2.5339 21
2.5339 21
3.5588 23
3.6676 26
3.6668 26
1.1315 26
3.626 19
3.559 23
26 O ,O 3.804 22
3.4457 20
3.1227 21
3.5293 19
3.4469 20
3.1232 21
2.7059 23
3.5739 24
3.5301 19
2.7067 23
2.9305 26
1.1315 25
1.667 30
3.0235 31
2.44 33
2.343 23
3.6668 25
3.6673 25
3.5775 30
3.5779 30
3.7132 33
3.7135 33
2.3421 23
27 O ,O 3.804 10
3.4089 19
2.4969 21
3.4089 19
3.409 19
2.4968 21
2.4968 21
3.4089 19
3.4089 19
3.409 19
1.624 27
28 Cl ,Cl 4.344 32
3.3317 25
1.3298 29
2.3509 30
1.4489 31
1.6089 32
1.4881 33
3.3317 25
3.3317 25
1.3298 29
1.3298 29
2.3508 30
2.3508 30
1.488 33
1.488 33
3.6661 22
4.2471 23
3.6662 22
3.6663 22
4.2473 23
4.2473 23
3.6661 22
4.2471 23
3.6662 22
3.6663 22
4.2473 23
4.2473 23
4.0471 17
3.9277 26
4.0471 17
4.047 17
3.9275 26
3.9276 26
29 Cl ,Cl 4.344 25
4.3117 25
1.3298 28
3.3008 30
2.7254 31
0.6354 32
2.3929 33
0.8814 29
0.8814 29
3.5798 30
3.5798 30
2.6884 33
2.6884 33
3.5081 22
3.9976 22
3.1322 22
3.8963 24
3.132 22
3.5083 22
3.9977 22
4.1239 15
2.9724 17
4.1239 15
3.8306 15
2.9724 17
3.5211 17
30 Cl ,Cl 4.344 29
1.0115 25
2.3509 28
3.3008 29
1.3676 31
3.8088 32
0.9116 33
2.6044 25
2.6044 25
3.5798 29
3.5798 29
2.1781 30
2.1781 30
2.1308 33
2.1308 33
3.9858 22
2.9248 23
4.0959 24
3.9857 22
2.9246 23
4.0739 21
3.726 20
3.726 20
3.3158 21
3.3158 21
4.1961 23
3.5781 26
3.5775 26
1.667 26
4.1963 23
31 Cl ,Cl 4.344 32
2.1491 25
1.4489 28
2.7254 29
1.3676 30
3.0578 32
1.0379 33
2.149 25
2.149 25
2.7254 29
2.7254 29
1.3675 30
1.3674 30
1.0378 33
1.0378 33
4.3011 22
3.9982 23
4.3013 22
4.3013 22
3.9984 23
3.9984 23
4.3011 22
3.9982 23
4.3013 22
4.3013 22
3.9984 23
3.9984 23
3.8479 21
3.8479 21
3.8479 21
3.0236 26
3.0234 26
3.0235 26
32 Cl ,Cl 4.344 23
1.6089 28
0.6354 29
3.8088 30
3.0578 31
2.8977 33
0.6353 29
0.6353 29
3.8087 30
3.8087 30
2.8977 33
2.8977 33
3.5695 22
3.5697 22
3.5698 22
3.5695 22
3.5697 22
3.5698 22
3.6477 15
2.8859 17
3.6477 15
3.6477 15
2.8859 17
2.8858 17
33 Cl ,Cl 4.344 30
1.9228 25
1.4881 28
2.3929 29
0.9116 30
1.0379 31
2.8977 32
2.8637 25
2.8637 25
2.6884 29
2.6884 29
2.1308 30
2.1308 30
1.7031 33
1.703 33
4.1447 22
4.2589 23
3.515 22
3.125 23
3.8309 24
3.5148 22
3.1248 23
4.1449 22
4.2592 23
4.2371 20
4.2371 20
4.0964 21
4.0964 21
3.7138 26
3.7132 26
2.44 26
X-ray diffraction powder data (II), X-Ray W.L. = 1.78892(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 1 0 1 4.487 8.974 0.044 323.78 6 39.8 10.9
2 0 0 3 5.1 10.2 0.05 250.11 2 62.3 6.9
3 1 0 -2 5.369 10.738 0.052 225.47 6 108.0 55.8
4 1 1 0 7.204 14.409 0.07 124.21 6 296.4 231.4
5 1 0 4 7.984 15.968 0.078 100.73 6 369.8 292.1
6 2 0 -1 8.5 17.0 0.083 88.6 6 199.0 74.4
7 1 1 3 8.843 17.685 0.086 81.7 12 2.3 0.0
8 2 0 2 9.002 18.004 0.087 78.76 6 503.0 422.6
9 1 0 -5 9.492 18.983 0.092 70.62 6 323.3 156.6
10 0 0 6 10.241 20.482 0.099 60.36 2 279.9 33.4
11 2 0 -4 10.786 21.571 0.105 54.21 6 18.7 0.4
12 2 1 1 11.177 22.354 0.108 50.33 12 38.6 3.2
13 2 1 -2 11.568 23.135 0.112 46.85 12 100.3 20.0
14 2 0 5 11.957 23.914 0.116 43.72 6 531.7 262.0
15 3 0 0 12.546 25.091 0.121 39.52 6 209.0 36.6
16 1 1 6 12.566 25.133 0.122 39.38 12 321.8 173.0
17 1 0 7 12.691 25.382 0.123 38.57 6 156.0 19.9
18 2 1 4 13.019 26.037 0.126 36.55 12 327.9 166.7
19 3 0 -3 13.574 27.148 0.131 33.46 6 158.4 17.8
20 3 0 3 13.574 27.148 0.131 33.46 6 527.5 197.4
21 2 1 -5 14.015 28.03 0.135 31.27 12 56.3 4.2
22 1 0 -8 14.351 28.702 0.139 29.73 6 307.6 59.6
23 2 2 0 14.526 29.052 0.14 28.97 6 439.9 118.9
24 2 0 -7 14.653 29.307 0.141 28.43 6 326.5 64.3
25 3 1 -1 15.233 30.465 0.147 26.17 12 433.5 208.6
26 2 2 3 15.433 30.865 0.149 25.44 12 110.1 13.1
27 0 0 9 15.467 30.934 0.149 25.32 2 170.2 5.2
28 3 1 2 15.528 31.055 0.15 25.11 12 279.1 82.9
29 2 0 8 16.128 32.256 0.155 23.14 6 521.7 133.5
30 3 0 -6 16.302 32.604 0.157 22.61 6 404.6 78.5
31 3 0 6 16.302 32.604 0.157 22.61 6 142.9 9.8
32 2 1 7 16.4 32.801 0.158 22.31 12 260.3 64.1
33 3 1 -4 16.661 33.322 0.16 21.56 12 44.7 1.8
34 4 0 1 16.926 33.852 0.163 20.84 6 6.3 0.0
35 1 1 9 17.14 34.279 0.165 20.28 12 367.0 115.8
36 4 0 -2 17.195 34.39 0.165 20.13 6 360.3 55.4
37 3 1 5 17.468 34.936 0.168 19.45 12 674.2 375.1
38 2 1 -8 17.745 35.49 0.17 18.8 12 255.1 51.9
39 1 0 10 17.76 35.52 0.171 18.76 6 124.7 6.2
40 2 2 6 17.905 35.81 0.172 18.43 12 374.8 109.8
41 4 0 4 18.236 36.473 0.175 17.7 6 1055.8 418.5
42 3 2 1 18.481 36.963 0.177 17.19 12 43.9 1.4
43 3 2 -2 18.731 37.462 0.18 16.69 12 66.6 3.1
44 4 0 -5 18.985 37.97 0.182 16.2 6 250.2 21.5
45 2 0 -10 19.257 38.514 0.184 15.7 6 558.0 103.6
46 4 1 0 19.378 38.756 0.185 15.48 12 184.9 22.4
47 3 1 -7 19.477 38.954 0.186 15.31 12 440.4 125.9
48 1 0 -11 19.505 39.01 0.187 15.26 6 70.6 1.6
49 3 2 4 19.702 39.404 0.188 14.93 12 375.2 89.1
50 4 1 -3 20.091 40.181 0.192 14.29 12 8.5 0.0
51 4 1 3 20.091 40.181 0.192 14.29 12 189.2 21.7
52 3 0 -9 20.118 40.236 0.192 14.25 6 533.0 85.8
53 3 0 9 20.118 40.236 0.192 14.25 6 250.2 18.9
54 3 2 -5 20.405 40.81 0.195 13.81 12 33.2 0.6
55 3 1 8 20.648 41.296 0.197 13.45 12 72.3 3.0
56 2 1 10 20.662 41.323 0.197 13.43 12 163.1 15.2
57 0 0 12 20.829 41.658 0.199 13.19 2 583.1 31.7
58 4 0 7 20.869 41.738 0.199 13.13 6 50.0 0.7
59 2 0 11 20.896 41.791 0.199 13.09 6 44.0 0.5
60 5 0 -1 21.299 42.598 0.203 12.54 6 304.7 24.7
61 2 2 9 21.475 42.951 0.205 12.31 12 207.4 22.5
62 5 0 2 21.521 43.042 0.205 12.25 6 79.4 1.6
63 4 0 -8 21.979 43.958 0.209 11.69 6 345.3 29.5
64 3 3 0 22.1 44.201 0.21 11.54 6 217.5 11.6
65 4 1 -6 22.113 44.226 0.21 11.53 12 112.6 6.2
66 4 1 6 22.113 44.226 0.21 11.53 12 89.2 3.9
67 1 1 12 22.151 44.302 0.211 11.48 12 21.0 0.2
68 3 2 7 22.189 44.378 0.211 11.44 12 134.9 8.8
69 2 1 -11 22.214 44.429 0.211 11.41 12 42.9 0.9
70 5 0 -4 22.392 44.783 0.213 11.21 6 19.2 0.1
71 4 2 -1 22.599 45.198 0.215 10.98 12 411.2 78.7
72 3 3 3 22.742 45.485 0.216 10.82 12 139.7 9.0
73 4 2 2 22.811 45.622 0.217 10.75 12 210.5 20.2
74 5 0 5 23.027 46.055 0.219 10.52 6 63.5 0.9
75 1 0 13 23.076 46.153 0.219 10.47 6 170.6 6.5
76 3 2 -8 23.248 46.497 0.221 10.3 12 256.2 28.7
77 3 1 -10 23.261 46.521 0.221 10.28 12 186.6 15.2
78 4 2 -4 23.644 47.287 0.224 9.91 12 22.1 0.2
79 5 1 1 23.842 47.685 0.226 9.72 12 276.8 31.6
80 5 1 -2 24.046 48.092 0.228 9.54 12 270.2 29.5
81 4 2 5 24.254 48.508 0.23 9.35 12 212.6 17.9
82 2 0 -13 24.301 48.602 0.23 9.31 6 79.2 1.2
83 4 0 10 24.478 48.956 0.232 9.16 6 818.4 130.1
84 3 3 6 24.59 49.18 0.233 9.06 12 178.7 12.3
85 3 0 -12 24.625 49.25 0.233 9.04 6 24.1 0.1
86 3 0 12 24.625 49.25 0.233 9.04 6 16.9 0.1
87 5 0 -7 24.66 49.321 0.233 9.01 6 32.8 0.2
88 3 1 11 24.684 49.367 0.233 8.99 12 288.6 31.8
89 5 1 4 24.847 49.694 0.235 8.85 12 358.7 48.3
90 1 0 -14 24.905 49.81 0.235 8.81 6 370.9 25.7
91 4 1 -9 25.194 50.389 0.238 8.58 12 231.4 19.5
92 4 1 9 25.194 50.389 0.238 8.58 12 88.2 2.8
93 5 1 -5 25.436 50.872 0.24 8.39 12 216.2 16.6
94 2 1 13 25.481 50.962 0.24 8.36 12 48.0 0.8
95 5 0 8 25.641 51.282 0.242 8.24 6 282.4 13.9
96 3 2 10 25.652 51.305 0.242 8.23 12 299.6 31.3
97 6 0 0 25.749 51.498 0.243 8.16 6 27.5 0.1
98 2 2 12 25.794 51.588 0.243 8.13 12 179.9 11.2
99 4 2 -7 25.828 51.657 0.244 8.11 12 221.3 16.8
100 4 0 -11 25.851 51.702 0.244 8.09 6 16.0 0.0
101 2 0 14 26.065 52.13 0.246 7.94 6 1.0 0.0
102 4 3 1 26.195 52.389 0.247 7.85 12 166.2 9.2
103 6 0 -3 26.323 52.646 0.248 7.76 6 270.9 12.1
104 6 0 3 26.323 52.646 0.248 7.76 6 18.6 0.1
105 4 3 -2 26.385 52.769 0.248 7.72 12 61.8 1.3
106 0 0 15 26.39 52.779 0.248 7.72 2 218.4 2.6
107 4 2 8 26.778 53.557 0.252 7.47 12 525.8 87.5
108 5 2 0 26.883 53.766 0.253 7.4 12 26.9 0.2
109 5 1 7 26.96 53.92 0.253 7.35 12 74.1 1.7
110 3 2 -11 26.982 53.964 0.254 7.34 12 63.3 1.2
111 4 3 4 27.135 54.271 0.255 7.24 12 100.1 3.1
112 2 1 -14 27.19 54.379 0.255 7.21 12 98.7 3.0
113 5 2 -3 27.44 54.881 0.258 7.06 12 82.5 2.0
114 5 2 3 27.44 54.881 0.258 7.06 12 19.2 0.1
115 3 3 9 27.462 54.924 0.258 7.05 12 338.4 34.2
116 1 1 15 27.505 55.01 0.258 7.02 12 159.8 7.6
117 4 3 -5 27.689 55.379 0.26 6.92 12 284.3 23.7
118 3 1 -13 27.732 55.464 0.26 6.89 12 110.9 3.6
119 5 1 -8 27.883 55.766 0.261 6.81 12 17.8 0.1
120 5 0 -10 27.894 55.787 0.262 6.8 6 27.2 0.1
121 6 0 -6 27.996 55.991 0.262 6.75 6 351.8 17.7
122 6 0 6 27.996 55.991 0.262 6.75 6 563.1 45.4
123 6 1 -1 28.406 56.812 0.266 6.53 12 279.3 21.6
124 6 1 2 28.586 57.172 0.267 6.44 12 257.6 18.1
125 1 0 16 28.659 57.319 0.268 6.4 6 173.3 4.1
126 4 0 13 28.812 57.625 0.269 6.32 6 82.9 0.9
127 4 2 -10 28.97 57.94 0.271 6.25 12 327.3 28.4
128 5 2 -6 29.069 58.139 0.272 6.2 12 390.9 40.2
129 5 2 6 29.069 58.139 0.272 6.2 12 216.2 12.3
130 4 1 -12 29.101 58.201 0.272 6.18 12 196.3 10.1
131 4 1 12 29.101 58.201 0.272 6.18 12 327.5 28.1
132 4 3 7 29.132 58.264 0.272 6.17 12 216.9 12.3
133 5 0 11 29.153 58.306 0.272 6.16 6 186.0 4.5
134 6 1 -4 29.299 58.598 0.274 6.09 12 99.0 2.5
135 3 1 14 29.35 58.701 0.274 6.06 12 88.7 2.0
136 3 0 -15 29.651 59.302 0.277 5.93 6 175.7 3.9
137 3 0 15 29.651 59.302 0.277 5.93 6 68.2 0.6
138 2 0 -16 29.718 59.436 0.277 5.9 6 222.3 6.2
139 6 1 5 29.826 59.653 0.278 5.85 12 208.4 10.8
140 3 2 13 29.867 59.734 0.278 5.83 12 180.7 8.1
141 4 3 -8 30.011 60.022 0.28 5.77 12 27.7 0.2
142 5 1 10 30.021 60.043 0.28 5.76 12 328.8 26.4
143 4 4 0 30.108 60.217 0.28 5.73 6 1131.3 155.4
144 4 2 11 30.2 60.401 0.281 5.69 12 429.9 44.6
145 4 0 -14 30.394 60.788 0.283 5.61 6 903.5 97.1
146 5 3 -1 30.511 61.022 0.284 5.56 12 262.6 16.3
147 7 0 1 30.511 61.022 0.284 5.56 6 67.1 0.5
148 1 0 -17 30.592 61.183 0.284 5.53 6 22.3 0.1
149 4 4 3 30.628 61.255 0.285 5.51 12 27.8 0.2
150 6 0 -9 30.648 61.295 0.285 5.51 6 53.4 0.3
151 6 0 9 30.648 61.295 0.285 5.51 6 210.7 5.2
152 5 3 2 30.683 61.366 0.285 5.49 12 1.6 0.0
153 7 0 -2 30.683 61.366 0.285 5.49 6 39.0 0.2
154 2 2 15 30.688 61.376 0.285 5.49 12 316.0 23.2
155 2 1 16 30.753 61.507 0.286 5.46 12 82.7 1.6
156 3 3 12 31.176 62.353 0.289 5.3 12 223.3 11.2
157 6 1 -7 31.207 62.413 0.29 5.29 12 22.8 0.1
158 5 1 -11 31.226 62.453 0.29 5.28 12 49.1 0.5
159 5 3 -4 31.367 62.733 0.291 5.23 12 290.4 18.7
160 7 0 4 31.367 62.733 0.291 5.23 6 274.9 8.4
161 3 2 -14 31.416 62.832 0.291 5.21 12 330.8 24.2
162 6 2 1 31.531 63.062 0.292 5.17 12 247.5 13.4
163 2 0 17 31.61 63.221 0.293 5.14 6 228.9 5.7
164 5 2 -9 31.665 63.331 0.293 5.12 12 43.4 0.4
165 5 2 9 31.665 63.331 0.293 5.12 12 41.1 0.4
166 6 2 -2 31.7 63.4 0.294 5.11 12 360.7 28.2
167 5 3 5 31.874 63.747 0.295 5.05 12 3.1 0.0
168 7 0 -5 31.874 63.747 0.295 5.05 6 226.9 5.5
169 5 0 -13 31.913 63.826 0.296 5.04 6 144.5 2.2
170 6 1 8 32.052 64.103 0.297 4.99 12 168.2 6.0
171 4 3 10 32.061 64.123 0.297 4.99 12 7.0 0.0
172 4 4 6 32.155 64.31 0.298 4.95 12 542.5 61.8
173 0 0 18 32.233 64.467 0.298 4.93 2 497.6 8.6
174 6 2 4 32.372 64.743 0.299 4.88 12 203.1 8.5
175 2 1 -17 32.611 65.222 0.301 4.81 12 14.3 0.0
176 3 1 -16 32.767 65.535 0.303 4.76 12 103.8 2.2
177 6 2 -5 32.87 65.74 0.303 4.72 12 370.9 27.6
178 4 2 -13 32.909 65.818 0.304 4.71 12 396.7 31.5
179 7 1 0 33.137 66.275 0.306 4.64 12 25.1 0.1
180 5 3 -7 33.205 66.41 0.306 4.62 12 2.6 0.0
181 7 0 7 33.205 66.41 0.306 4.62 6 204.8 4.1
182 1 1 18 33.224 66.448 0.306 4.62 12 415.7 33.8
183 4 3 -11 33.224 66.449 0.306 4.62 12 18.4 0.1
184 5 0 14 33.408 66.816 0.308 4.56 6 165.3 2.6
185 7 1 -3 33.63 67.26 0.31 4.5 12 305.4 17.8
186 7 1 3 33.63 67.26 0.31 4.5 12 108.8 2.3
187 4 1 -15 33.687 67.375 0.31 4.48 12 35.7 0.2
188 4 1 15 33.687 67.375 0.31 4.48 12 113.2 2.4
189 4 0 16 33.75 67.5 0.311 4.47 6 998.0 94.3
190 5 1 13 33.889 67.779 0.312 4.43 12 41.8 0.3
191 5 3 8 34.024 68.047 0.313 4.39 12 58.8 0.6
192 7 0 -8 34.024 68.047 0.313 4.39 6 195.5 3.6
193 6 1 -10 34.033 68.066 0.313 4.39 12 418.4 32.6
194 6 0 -12 34.153 68.305 0.314 4.36 6 57.9 0.3
195 6 0 12 34.153 68.305 0.314 4.36 6 336.1 10.4
196 6 2 7 34.181 68.363 0.314 4.35 12 261.1 12.6
197 4 2 14 34.381 68.763 0.316 4.3 12 296.3 16.0
198 5 4 1 34.491 68.982 0.317 4.27 12 79.7 1.2
199 3 1 17 34.567 69.134 0.317 4.25 12 103.2 1.9
200 1 0 19 34.586 69.171 0.317 4.25 6 130.0 1.5
201 4 4 9 34.619 69.239 0.318 4.24 12 4.2 0.0
202 5 4 -2 34.653 69.305 0.318 4.23 12 127.4 2.9
203 3 2 16 34.719 69.437 0.318 4.21 12 380.4 25.9
204 6 2 -8 34.989 69.978 0.321 4.15 12 87.3 1.3
205 6 3 0 35.079 70.157 0.321 4.13 12 274.6 13.2
206 7 1 -6 35.088 70.176 0.321 4.12 12 3.0 0.0
207 7 1 6 35.088 70.176 0.321 4.12 12 49.7 0.4
208 5 2 -12 35.116 70.232 0.322 4.12 12 101.6 1.8
209 5 2 12 35.116 70.232 0.322 4.12 12 219.1 8.4
210 3 0 -18 35.163 70.326 0.322 4.11 6 177.4 2.7
211 3 0 18 35.163 70.326 0.322 4.11 6 26.6 0.1
212 6 1 11 35.163 70.327 0.322 4.11 12 87.1 1.3
213 5 4 4 35.295 70.591 0.323 4.08 12 397.4 27.3
214 5 1 -14 35.342 70.684 0.323 4.06 12 311.5 16.7
215 8 0 -1 35.451 70.901 0.324 4.04 6 237.1 4.8
216 4 0 -17 35.525 71.05 0.325 4.02 6 162.6 2.3
217 2 0 -19 35.544 71.088 0.325 4.02 6 29.1 0.1
218 6 3 -3 35.559 71.117 0.325 4.02 12 236.8 9.5
219 6 3 3 35.559 71.117 0.325 4.02 12 76.4 1.0
220 8 0 2 35.61 71.22 0.325 4.0 6 513.7 22.4
221 3 3 15 35.614 71.229 0.326 4.0 12 7.3 0.0
222 5 4 -5 35.774 71.548 0.327 3.97 12 124.0 2.6
223 4 3 13 35.811 71.622 0.327 3.96 12 273.9 12.6
224 5 3 -10 35.952 71.903 0.328 3.93 12 169.0 4.8
225 7 0 10 35.952 71.903 0.328 3.93 6 67.8 0.4
226 2 2 18 36.114 72.229 0.329 3.9 12 194.6 6.3
227 8 0 -4 36.245 72.491 0.331 3.87 6 385.7 12.2
228 7 2 -1 36.399 72.798 0.332 3.84 12 157.8 4.1
229 3 2 -17 36.473 72.946 0.332 3.82 12 7.9 0.0
230 2 1 19 36.491 72.982 0.332 3.82 12 4.3 0.0
231 7 2 2 36.557 73.114 0.333 3.81 12 239.1 9.2
232 5 0 -16 36.621 73.243 0.333 3.79 6 459.1 17.0
233 1 0 -20 36.658 73.316 0.334 3.79 6 199.0 3.2
234 8 0 5 36.719 73.438 0.334 3.77 6 9.5 0.0
235 6 2 10 36.895 73.789 0.336 3.74 12 337.0 18.0
236 6 3 -6 36.983 73.965 0.336 3.72 12 258.0 10.5
237 6 3 6 36.983 73.965 0.336 3.72 12 189.3 5.7
238 5 4 7 37.038 74.076 0.337 3.71 12 151.8 3.6
239 5 3 11 37.056 74.113 0.337 3.71 12 399.1 25.1
240 7 0 -11 37.056 74.113 0.337 3.71 6 425.1 14.2
241 7 2 -4 37.186 74.371 0.338 3.69 12 208.6 6.8
242 4 3 -14 37.231 74.463 0.338 3.68 12 170.3 4.5
243 7 1 -9 37.462 74.923 0.34 3.64 12 146.0 3.3
244 7 1 9 37.462 74.923 0.34 3.64 12 157.3 3.8
245 4 2 -16 37.558 75.116 0.341 3.62 12 474.9 34.6
246 2 0 20 37.594 75.189 0.341 3.61 6 195.2 2.9
247 7 2 5 37.655 75.309 0.341 3.6 12 198.1 6.0
248 6 1 -13 37.691 75.382 0.342 3.6 12 54.6 0.5
249 5 4 -8 37.82 75.639 0.343 3.57 12 209.6 6.7
250 4 4 12 37.943 75.887 0.344 3.55 12 437.4 28.8
251 8 0 -7 37.971 75.942 0.344 3.55 6 39.8 0.1
252 6 2 -11 37.989 75.978 0.344 3.55 12 188.8 5.4
253 8 1 1 38.268 76.536 0.346 3.5 12 221.9 7.3
254 5 0 17 38.341 76.681 0.347 3.49 6 130.6 1.3
255 3 1 -19 38.359 76.717 0.347 3.49 12 334.8 16.6
256 8 1 -2 38.423 76.846 0.347 3.48 12 59.4 0.5
257 6 0 -15 38.427 76.855 0.347 3.48 6 362.1 9.7
258 6 0 15 38.427 76.855 0.347 3.48 6 323.9 7.7
259 0 0 21 38.482 76.963 0.348 3.47 2 308.5 2.3
260 5 1 16 38.487 76.973 0.348 3.47 12 120.8 2.1
261 2 1 -20 38.523 77.045 0.348 3.46 12 312.1 14.3
262 8 0 8 38.746 77.493 0.35 3.43 6 529.8 20.4
263 5 5 0 38.833 77.665 0.351 3.41 6 487.9 17.2
264 7 2 -7 38.896 77.792 0.351 3.4 12 74.1 0.8
265 4 1 -18 38.914 77.828 0.351 3.4 12 199.2 5.7
266 4 1 18 38.914 77.828 0.351 3.4 12 111.5 1.8
267 8 1 4 39.042 78.083 0.352 3.38 12 52.2 0.4
268 6 1 14 39.087 78.173 0.352 3.38 12 9.5 0.0
269 6 4 -1 39.191 78.382 0.353 3.36 12 365.0 19.0
270 4 2 17 39.263 78.526 0.354 3.35 12 17.2 0.0
271 4 0 19 39.281 78.562 0.354 3.35 6 142.7 1.4
272 5 5 3 39.295 78.591 0.354 3.35 12 6.6 0.0
273 6 3 -9 39.313 78.627 0.354 3.35 12 0.3 0.0
274 6 3 9 39.313 78.627 0.354 3.35 12 133.8 2.5
275 6 4 2 39.345 78.69 0.354 3.34 12 387.8 21.3
276 5 2 -15 39.349 78.699 0.354 3.34 12 298.7 12.6
277 5 2 15 39.349 78.699 0.354 3.34 12 108.6 1.7
278 1 1 21 39.403 78.807 0.355 3.33 12 167.5 4.0
279 8 1 -5 39.504 79.007 0.356 3.32 12 470.0 31.1
280 5 3 -13 39.539 79.079 0.356 3.31 12 51.1 0.4
281 7 0 13 39.539 79.079 0.356 3.31 6 131.4 1.2
282 7 2 8 39.666 79.332 0.357 3.3 12 59.3 0.5
283 5 4 10 39.675 79.35 0.357 3.3 12 53.7 0.4
284 6 4 -4 39.96 79.919 0.359 3.26 12 215.3 6.4
285 7 3 1 40.108 80.217 0.36 3.24 12 247.0 8.4
286 5 1 -17 40.18 80.36 0.361 3.23 12 103.6 1.5
287 3 2 19 40.198 80.396 0.361 3.23 12 138.9 2.6
288 7 3 -2 40.261 80.523 0.361 3.22 12 76.4 0.8
289 4 3 16 40.324 80.648 0.362 3.22 12 156.8 3.4
290 3 1 20 40.36 80.72 0.362 3.21 12 300.9 12.3
291 6 4 5 40.419 80.838 0.362 3.2 12 171.4 4.0
292 6 2 13 40.455 80.909 0.363 3.2 12 114.2 1.8
293 8 0 -10 40.589 81.179 0.364 3.18 6 735.7 36.5
294 9 0 0 40.666 81.332 0.364 3.18 6 73.3 0.4
295 5 5 6 40.675 81.35 0.364 3.17 12 686.5 63.4
296 7 1 -12 40.702 81.403 0.365 3.17 12 62.5 0.5
297 7 1 12 40.702 81.403 0.365 3.17 12 101.4 1.4
298 8 1 7 40.729 81.458 0.365 3.17 12 250.9 8.5
299 3 3 18 40.746 81.493 0.365 3.17 12 126.7 2.2
300 5 4 -11 40.747 81.493 0.365 3.17 12 109.6 1.6
301 7 3 4 40.872 81.745 0.366 3.15 12 220.8 6.5
302 5 3 14 40.917 81.834 0.366 3.15 12 103.4 1.4
303 7 0 -14 40.917 81.834 0.366 3.15 6 94.6 0.6
304 1 0 22 40.988 81.976 0.367 3.14 6 23.2 0.0
305 9 0 -3 41.123 82.247 0.368 3.12 6 75.6 0.4
306 9 0 3 41.123 82.247 0.368 3.12 6 136.4 1.2
307 3 0 -21 41.23 82.461 0.368 3.11 6 555.5 20.4
308 3 0 21 41.23 82.461 0.368 3.11 6 272.8 4.9
309 4 0 -20 41.271 82.541 0.369 3.11 6 629.5 26.1
310 7 3 -5 41.329 82.659 0.369 3.1 12 108.5 1.5
311 8 1 -8 41.49 82.981 0.37 3.09 12 192.1 4.8
312 7 2 -10 41.499 82.999 0.37 3.09 12 201.5 5.3
313 8 2 0 41.575 83.151 0.371 3.08 12 521.8 35.6
314 6 4 -7 41.638 83.276 0.371 3.07 12 259.1 8.7
315 8 0 11 41.656 83.312 0.372 3.07 6 26.2 0.0
316 6 2 -14 41.825 83.651 0.373 3.05 12 353.3 16.2
317 2 0 -22 41.896 83.793 0.373 3.05 6 471.3 14.4
318 4 3 -17 41.999 83.999 0.374 3.04 12 197.9 5.0
319 5 0 -19 42.017 84.034 0.374 3.04 6 549.4 19.4
320 8 2 -3 42.031 84.062 0.374 3.04 12 66.8 0.6
321 8 2 3 42.031 84.062 0.374 3.04 12 260.6 8.7
322 4 4 15 42.084 84.169 0.375 3.03 12 125.5 2.0
323 2 2 21 42.137 84.275 0.375 3.03 12 257.7 8.5
324 6 1 -16 42.142 84.284 0.375 3.03 12 111.1 1.6
325 3 2 -20 42.178 84.355 0.375 3.02 12 53.5 0.4
326 6 4 8 42.397 84.793 0.377 3.0 12 202.3 5.2
327 9 0 -6 42.49 84.981 0.378 3.0 6 201.6 2.6
328 9 0 6 42.49 84.981 0.378 3.0 6 97.3 0.6
329 6 3 -12 42.517 85.034 0.378 2.99 12 1.9 0.0
330 6 3 12 42.517 85.034 0.378 2.99 12 22.2 0.1
331 7 3 7 42.544 85.088 0.378 2.99 12 175.2 3.9
332 7 2 11 42.562 85.123 0.378 2.99 12 26.4 0.1
333 2 1 22 42.801 85.603 0.38 2.97 12 176.1 3.9
334 4 2 -19 42.922 85.844 0.381 2.96 12 50.6 0.3
335 5 5 9 42.953 85.907 0.381 2.96 12 12.0 0.0
336 5 4 13 43.176 86.351 0.382 2.94 12 110.8 1.5
337 1 0 -23 43.264 86.528 0.383 2.93 6 101.9 0.6
338 7 3 -8 43.3 86.601 0.383 2.93 12 161.8 3.3
339 8 1 10 43.309 86.619 0.383 2.93 12 177.2 3.9
340 8 2 -6 43.394 86.788 0.384 2.92 12 179.7 4.0
341 8 2 6 43.394 86.788 0.384 2.92 12 52.9 0.3
342 6 0 -18 43.465 86.929 0.385 2.92 6 489.4 14.8
343 6 0 18 43.465 86.929 0.385 2.92 6 88.0 0.5
344 6 5 1 43.736 87.472 0.386 2.9 12 94.9 1.1
345 9 1 -1 43.736 87.472 0.386 2.9 12 177.2 3.9
346 6 1 17 43.807 87.614 0.387 2.9 12 169.5 3.5
347 5 1 19 43.824 87.649 0.387 2.9 12 67.6 0.6
348 6 5 -2 43.887 87.774 0.388 2.89 12 63.1 0.5
349 9 1 2 43.887 87.774 0.388 2.89 12 273.8 9.2
350 5 3 -16 43.949 87.898 0.388 2.89 12 98.3 1.2
351 7 0 16 43.949 87.898 0.388 2.89 6 87.3 0.5
352 5 0 20 43.984 87.969 0.388 2.89 6 49.7 0.2
353 8 0 -13 44.078 88.156 0.389 2.88 6 244.4 3.6
354 2 0 23 44.166 88.332 0.389 2.87 6 122.4 0.9
355 6 4 -10 44.211 88.423 0.39 2.87 12 221.1 6.0
356 7 4 0 44.287 88.574 0.39 2.87 12 24.3 0.1
357 5 2 -18 44.366 88.733 0.391 2.86 12 260.6 8.2
358 5 2 18 44.366 88.733 0.391 2.86 12 73.6 0.7
359 8 1 -11 44.367 88.733 0.391 2.86 12 136.0 2.2
360 6 5 4 44.491 88.982 0.392 2.86 12 201.0 4.9
361 9 1 -4 44.491 88.982 0.392 2.86 12 92.6 1.0
362 5 4 -14 44.535 89.071 0.392 2.85 12 238.4 6.9
363 3 1 -22 44.606 89.212 0.393 2.85 12 140.4 2.4
364 7 4 -3 44.74 89.48 0.393 2.84 12 306.7 11.3
365 7 4 3 44.74 89.48 0.393 2.84 12 253.9 7.8
366 9 0 -9 44.757 89.515 0.394 2.84 6 276.0 4.6
367 9 0 9 44.757 89.515 0.394 2.84 6 15.4 0.0
368 7 1 -15 44.793 89.585 0.394 2.84 12 66.0 0.5
369 7 1 15 44.793 89.585 0.394 2.84 12 75.6 0.7
370 4 1 -21 44.846 89.691 0.394 2.84 12 260.8 8.2
371 4 1 21 44.846 89.691 0.394 2.84 12 47.4 0.3
372 6 2 16 44.85 89.701 0.394 2.84 12 255.2 7.8
373 4 2 20 44.886 89.771 0.394 2.83 12 62.7 0.5
374 6 5 -5 44.944 89.888 0.395 2.83 12 12.9 0.0
375 9 1 5 44.944 89.888 0.395 2.83 12 60.7 0.4
376 7 2 -13 44.979 89.958 0.395 2.83 12 54.1 0.4
X-ray diffraction powder data (I)...X-Ray wave length = 1.78892 (angs.):
No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si)
( degree ) (angstrem) *100 *100
1 1 0 1 4.487 8.974 11.43313 10.9 2.6 2.6 5.6
2 0 0 3 5.1 10.2 10.062 6.9 1.6 1.6 5.6
3 1 0 2 5.369 10.738 9.55963 55.8 13.2 13.3 5.6
4 1 1 0 7.204 14.409 7.1323 231.4 54.8 54.9 5.6
5 1 0 4 7.984 15.968 6.43996 292.1 69.1 69.2 5.6
6 2 0 1 8.5 17.0 6.05136 74.4 17.6 17.6 5.6
7 2 0 2 9.002 18.004 5.71656 422.6 100.0 100.0 5.6
8 1 0 5 9.492 18.983 5.42412 156.6 37.1 37.0 5.6
9 0 0 6 10.241 20.482 5.031 33.4 7.9 7.9 5.6
10 2 1 2 11.568 23.135 4.46061 20.0 4.7 4.7 5.6
11 2 0 5 11.957 23.914 4.31744 262.0 62.0 61.8 5.6
12 1 1 6 12.566 25.133 4.11113 209.6 49.6 49.3 5.6
13 1 0 7 12.691 25.382 4.07136 19.9 4.7 4.7 5.6
14 2 1 4 13.019 26.037 3.97062 166.7 39.5 39.2 5.6
15 3 0 3 13.574 27.148 3.81104 215.2 50.9 50.6 5.6
16 1 0 8 14.351 28.702 3.60867 59.6 14.1 14.0 5.6
17 2 2 0 14.526 29.052 3.56615 118.9 28.1 27.9 5.6
18 2 0 7 14.653 29.307 3.53584 64.3 15.2 15.1 5.6
19 3 1 1 15.233 30.465 3.40439 208.6 49.4 48.9 5.6
20 2 2 3 15.433 30.865 3.36128 13.1 3.1 3.1 5.6
21 0 0 9 15.467 30.934 3.354 5.2 1.2 1.2 5.6
22 3 1 2 15.528 31.055 3.34123 82.9 19.6 19.4 5.6
23 2 0 8 16.128 32.256 3.21998 133.5 31.6 31.3 5.6
24 3 0 6 16.302 32.604 3.18654 88.2 20.9 20.7 5.6
25 2 1 7 16.4 32.801 3.16792 64.1 15.2 15.0 5.6
26 1 1 9 17.14 34.279 3.03515 115.8 27.4 27.1 5.7
27 4 0 2 17.195 34.39 3.02568 55.4 13.1 13.0 5.7
28 3 1 5 17.468 34.936 2.97982 375.1 88.8 87.6 5.7
29 2 1 8 17.745 35.49 2.93476 58.1 13.7 13.6 5.7
30 2 2 6 17.905 35.81 2.90938 109.8 26.0 25.6 5.7
31 4 0 4 18.236 36.473 2.85828 418.5 99.0 97.6 5.7
32 4 0 5 18.985 37.97 2.7495 21.5 5.1 5.0 5.7
33 2 0 10 19.257 38.514 2.71206 103.6 24.5 24.1 5.7
34 4 1 0 19.378 38.756 2.69576 22.4 5.3 5.2 5.7
35 3 1 7 19.477 38.954 2.68259 127.5 30.2 29.7 5.7
36 3 2 4 19.702 39.404 2.65316 89.1 21.1 20.7 5.7
37 3 0 9 20.118 40.236 2.60053 126.4 29.9 29.4 5.7
38 2 1 10 20.662 41.323 2.53498 18.1 4.3 4.2 5.7
39 0 0 12 20.829 41.658 2.5155 31.7 7.5 7.4 5.7
40 5 0 1 21.299 42.598 2.46247 24.7 5.8 5.7 5.7
41 2 2 9 21.475 42.951 2.4432 22.5 5.3 5.2 5.7
42 4 0 8 21.979 43.958 2.38991 29.5 7.0 6.8 5.7
43 3 3 0 22.1 44.201 2.37743 21.7 5.1 5.0 5.7
44 3 2 7 22.189 44.378 2.36839 9.7 2.3 2.2 5.7
45 4 2 1 22.599 45.198 2.32764 78.7 18.6 18.2 5.7
46 3 3 3 22.742 45.485 2.31373 9.0 2.1 2.1 5.7
47 4 2 2 22.811 45.622 2.30716 20.2 4.8 4.7 5.7
48 1 0 13 23.076 46.153 2.28204 6.5 1.5 1.5 5.7
49 3 2 8 23.248 46.497 2.26607 43.8 10.4 10.1 5.7
50 5 1 1 23.842 47.685 2.21279 31.6 7.5 7.3 5.7
51 5 1 2 24.046 48.092 2.19516 29.5 7.0 6.8 5.7
52 4 2 5 24.254 48.508 2.17746 17.9 4.2 4.1 5.7
53 4 0 10 24.478 48.956 2.15872 130.1 30.8 29.9 5.7
54 3 3 6 24.59 49.18 2.14951 12.3 2.9 2.8 5.7
55 3 1 11 24.684 49.367 2.14187 31.8 7.5 7.3 5.7
56 5 1 4 24.847 49.694 2.12866 48.3 11.4 11.1 5.7
57 1 0 14 24.905 49.81 2.12403 25.7 6.1 5.9 5.7
58 4 1 9 25.194 50.389 2.10119 22.3 5.3 5.1 5.8
59 5 1 5 25.436 50.872 2.08257 16.6 3.9 3.8 5.8
60 3 2 10 25.652 51.305 2.06615 45.3 10.7 10.4 5.8
61 2 2 12 25.794 51.588 2.05557 11.2 2.6 2.6 5.8
62 4 2 7 25.828 51.657 2.05303 16.9 4.0 3.9 5.8
63 4 3 1 26.195 52.389 2.02632 9.2 2.2 2.1 5.8
64 6 0 3 26.323 52.646 2.01712 12.1 2.9 2.8 5.8
65 4 2 8 26.778 53.557 1.98531 87.5 20.7 20.0 5.8
66 3 3 9 27.462 54.924 1.93958 36.4 8.6 8.3 5.8
67 1 1 15 27.505 55.01 1.93678 7.6 1.8 1.7 5.8
68 4 3 5 27.689 55.379 1.92491 23.7 5.6 5.4 5.8
69 6 0 6 27.996 55.991 1.90552 63.1 14.9 14.4 5.8
70 6 1 1 28.406 56.812 1.88023 21.6 5.1 4.9 5.8
71 6 1 2 28.586 57.172 1.86939 18.1 4.3 4.1 5.8
72 4 2 10 28.97 57.94 1.84672 28.4 6.7 6.5 5.8
73 5 2 6 29.069 58.139 1.84095 52.5 12.4 11.9 5.8
74 4 1 12 29.101 58.201 1.83915 38.2 9.0 8.7 5.8
75 4 3 7 29.132 58.264 1.83734 16.8 4.0 3.8 5.8
76 3 0 15 29.651 59.302 1.80804 4.5 1.1 1.0 5.8
77 2 0 16 29.718 59.436 1.80434 6.2 1.5 1.4 5.8
78 6 1 5 29.826 59.653 1.79837 10.8 2.6 2.4 5.8
79 3 2 13 29.867 59.734 1.79613 8.1 1.9 1.8 5.8
80 5 1 10 30.021 60.043 1.78777 26.4 6.3 6.0 5.8
81 4 4 0 30.108 60.217 1.78307 155.4 36.8 35.2 5.8
82 4 2 11 30.2 60.401 1.77817 44.6 10.6 10.1 5.8
83 4 0 14 30.394 60.788 1.76792 97.1 23.0 22.0 5.8
84 5 3 1 30.511 61.022 1.76178 16.8 4.0 3.8 5.8
85 6 0 9 30.648 61.295 1.75468 5.2 1.2 1.2 5.8
86 2 2 15 30.688 61.376 1.7526 23.2 5.5 5.3 5.8
87 3 3 12 31.176 62.353 1.72785 11.2 2.7 2.5 5.8
88 5 3 4 31.367 62.733 1.71842 27.1 6.4 6.1 5.9
89 3 2 14 31.416 62.832 1.71599 24.2 5.7 5.5 5.9
90 6 2 1 31.531 63.062 1.71037 13.4 3.2 3.0 5.9
91 2 0 17 31.61 63.221 1.70653 5.7 1.4 1.3 5.9
92 6 2 2 31.7 63.4 1.70219 28.2 6.7 6.4 5.9
93 7 0 5 31.874 63.747 1.6939 5.5 1.3 1.2 5.9
94 6 1 8 32.052 64.103 1.68549 6.0 1.4 1.4 5.9
95 4 4 6 32.155 64.31 1.68064 61.8 14.6 13.9 5.9
96 0 0 18 32.233 64.467 1.677 8.6 2.0 1.9 5.9
97 6 2 4 32.372 64.743 1.67062 8.5 2.0 1.9 5.9
98 6 2 5 32.87 65.74 1.64806 27.6 6.5 6.2 5.9
99 4 2 13 32.909 65.818 1.64634 31.5 7.4 7.1 5.9
100 1 1 18 33.224 66.448 1.63248 38.0 9.0 8.5 5.9
101 7 1 3 33.63 67.26 1.61505 20.1 4.7 4.5 5.9
102 4 0 16 33.75 67.5 1.60999 94.3 22.3 21.1 5.9
103 6 1 10 34.033 68.066 1.59819 36.1 8.6 8.1 5.9
104 6 2 7 34.181 68.363 1.59209 23.0 5.4 5.2 5.9
105 4 2 14 34.381 68.763 1.58396 16.0 3.8 3.6 5.9
106 3 2 16 34.719 69.437 1.57047 25.9 6.1 5.8 5.9
107 6 3 0 35.079 70.157 1.5564 13.6 3.2 3.0 5.9
108 5 2 12 35.116 70.232 1.55495 10.2 2.4 2.3 5.9
109 5 4 4 35.295 70.591 1.54807 27.3 6.5 6.1 5.9
110 5 1 14 35.342 70.684 1.54628 16.7 4.0 3.7 5.9
111 8 0 1 35.451 70.901 1.54217 4.8 1.1 1.1 5.9
112 6 3 3 35.559 71.117 1.5381 10.5 2.5 2.3 5.9
113 8 0 2 35.61 71.22 1.53617 22.4 5.3 5.0 5.9
114 4 3 13 35.811 71.622 1.52869 12.6 3.0 2.8 5.9
115 5 3 10 35.952 71.903 1.52352 5.1 1.2 1.1 5.9
116 2 2 18 36.114 72.229 1.51758 6.3 1.5 1.4 5.9
117 8 0 4 36.245 72.491 1.51284 12.2 2.9 2.7 5.9
118 7 2 2 36.557 73.114 1.50173 9.2 2.2 2.0 6.0
119 5 0 16 36.621 73.243 1.49946 17.0 4.0 3.8 6.0
120 6 2 10 36.895 73.789 1.48991 18.0 4.3 4.0 6.0
121 6 3 6 36.983 73.965 1.48687 16.2 3.8 3.6 6.0
122 7 0 11 37.056 74.113 1.48434 42.9 10.2 9.5 6.0
123 7 2 4 37.186 74.371 1.47992 6.8 1.6 1.5 6.0
124 4 3 14 37.231 74.463 1.47836 4.5 1.1 1.0 6.0
125 7 1 9 37.462 74.923 1.47059 7.1 1.7 1.6 6.0
126 4 2 16 37.558 75.116 1.46738 34.6 8.2 7.7 6.0
127 7 2 5 37.655 75.309 1.46416 6.0 1.4 1.3 6.0
128 5 4 8 37.82 75.639 1.45873 6.7 1.6 1.5 6.0
129 4 4 12 37.943 75.887 1.45469 29.0 6.9 6.4 6.0
130 6 2 11 37.989 75.978 1.4532 5.4 1.3 1.2 6.0
131 8 1 1 38.268 76.536 1.44421 7.3 1.7 1.6 6.0
132 3 1 19 38.359 76.717 1.44132 17.8 4.2 3.9 6.0
133 6 0 15 38.427 76.855 1.43915 17.4 4.1 3.8 6.0
134 0 0 21 38.482 76.963 1.43743 4.5 1.1 1.0 6.0
135 2 1 20 38.523 77.045 1.43613 14.3 3.4 3.1 6.0
136 8 0 8 38.746 77.493 1.42914 20.4 4.8 4.5 6.0
137 5 5 0 38.833 77.665 1.42646 17.2 4.1 3.8 6.0
138 4 1 18 38.914 77.828 1.42395 7.5 1.8 1.7 6.0
139 6 4 1 39.191 78.382 1.41549 19.0 4.5 4.2 6.0
140 6 4 2 39.345 78.69 1.41084 35.6 8.4 7.8 6.0
141 8 1 5 39.504 79.007 1.40611 31.1 7.4 6.8 6.0
142 6 4 4 39.96 79.919 1.3927 6.4 1.5 1.4 6.0
143 7 3 1 40.108 80.217 1.38841 8.4 2.0 1.8 6.0
144 3 1 20 40.36 80.72 1.38122 12.3 2.9 2.7 6.1
145 8 0 10 40.589 81.179 1.37475 36.5 8.6 8.0 6.1
146 5 5 6 40.675 81.35 1.37236 65.4 15.5 14.2 6.1
147 8 1 7 40.729 81.458 1.37086 12.2 2.9 2.7 6.1
148 7 3 4 40.872 81.745 1.36689 6.5 1.5 1.4 6.1
149 3 0 21 41.23 82.461 1.35712 25.3 6.0 5.5 6.1
150 4 0 20 41.271 82.541 1.35603 26.1 6.2 5.7 6.1
151 7 2 10 41.499 82.999 1.3499 10.1 2.4 2.2 6.1
152 8 2 0 41.575 83.151 1.34788 35.6 8.4 7.7 6.1
153 6 4 7 41.638 83.276 1.34622 8.8 2.1 1.9 6.1
154 6 2 14 41.825 83.651 1.3413 16.2 3.8 3.5 6.1
155 2 0 22 41.896 83.793 1.33944 14.4 3.4 3.1 6.1
156 5 0 19 42.017 84.034 1.33631 33.2 7.9 7.2 6.1
157 2 2 21 42.137 84.275 1.3332 10.1 2.4 2.2 6.1
158 6 4 8 42.397 84.793 1.32658 5.2 1.2 1.1 6.1
159 8 1 10 43.309 86.619 1.304 7.2 1.7 1.5 6.1
160 8 2 6 43.394 86.788 1.30196 4.4 1.0 0.9 6.1
161 6 0 18 43.465 86.929 1.30027 15.3 3.6 3.3 6.1
162 9 1 1 43.736 87.472 1.29381 5.0 1.2 1.1 6.2
163 9 1 2 43.887 87.774 1.29026 9.2 2.2 2.0 6.2
164 6 4 10 44.211 88.423 1.28274 6.0 1.4 1.3 6.2
165 5 2 18 44.366 88.733 1.27918 11.1 2.6 2.4 6.2
166 6 5 4 44.491 88.982 1.27634 5.9 1.4 1.3 6.2
167 5 4 14 44.535 89.071 1.27534 6.9 1.6 1.5 6.2
168 7 4 3 44.74 89.48 1.27074 23.7 5.6 5.1 6.2
169 4 1 21 44.846 89.691 1.26838 16.3 3.9 3.5 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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