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 ***
***********************
MULLITE
17, analogue, at 3.32 GPa
Al(5)BO(9)
Orthorhombic C mc2(1) Z = 4
R =0.1098 NR =401
31 .8 .10
Ref.Str.:
Gatta G.D., Rotiro N., Fisch M., Armbruster T. (2010)
* Phys. Chem. Minerals, 37, 227-236
R: N.A.D.
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 5.655 alpha = 90.0
b = 14.86 beta = 90.0
c = 7.652 gamma = 90.0
Unit cell volume (cub. angs.) = 643.02
Molar volume ( cub.cm/mol.) = 96.83
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.2528 0.1174 0.3325 0.0 Al = 1.00
2 0.0 0.2556 0.5207 0.0 Al = 1.00
3 0.0 0.4453 0.5188 0.0 Al = 1.00
4 0.0 0.2965 0.1677 0.0 Al = 1.00
5 0.0 0.0166 0.0513 0.0 B = 1.00
6 0.0 0.3265 0.7008 0.0 O = 1.00
7 0.259 0.1895 0.5343 0.0 O = 1.00
8 0.0 0.4554 0.9033 0.0 O = 1.00
9 0.0 0.0468 0.4194 0.0 O = 1.00
10 0.0 0.3516 0.3692 0.0 O = 1.00
11 0.0 0.1898 0.2626 0.0 O = 1.00
12 0.2112 0.0472 0.1216 0.0 O = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.2528 0.1174 0.3325
2 2 0.0 0.2556 0.5207
3 3 0.0 0.4453 0.5188
4 4 0.0 0.2965 0.1677
5 5 0.0 0.0166 0.0513
6 6 0.0 0.3265 0.7008
7 7 0.259 0.1895 0.5343
8 8 0.0 0.4554 0.9033
9 9 0.0 0.0468 0.4194
10 10 0.0 0.3516 0.3692
11 11 0.0 0.1898 0.2626
12 12 0.2112 0.0472 0.1216
13 1 0.7472 0.8826 0.8325
14 2 0.0 0.7444 0.0207
15 3 0.0 0.5547 0.0188
16 4 0.0 0.7035 0.6677
17 5 0.0 0.9834 0.5513
18 6 0.0 0.6735 0.2008
19 7 0.741 0.8105 0.0343
20 8 0.0 0.5446 0.4033
21 9 0.0 0.9532 0.9194
22 10 0.0 0.6484 0.8692
23 11 0.0 0.8102 0.7626
24 12 0.7888 0.9528 0.6216
25 1 0.7472 0.1174 0.3325
26 7 0.741 0.1895 0.5343
27 12 0.7888 0.0472 0.1216
28 1 0.2528 0.8826 0.8325
29 7 0.259 0.8105 0.0343
30 12 0.2112 0.9528 0.6216
31 1 0.2472 0.3826 0.8325
32 2 0.5 0.2444 0.0207
33 3 0.5 0.0547 0.0188
34 4 0.5 0.2035 0.6677
35 5 0.5 0.4834 0.5513
36 6 0.5 0.1735 0.2008
37 7 0.241 0.3105 0.0343
38 8 0.5 0.0446 0.4033
39 9 0.5 0.4532 0.9194
40 10 0.5 0.1484 0.8692
41 11 0.5 0.3102 0.7626
42 12 0.2888 0.4528 0.6216
43 1 0.7528 0.6174 0.3325
44 2 0.5 0.7556 0.5207
45 3 0.5 0.9453 0.5188
46 4 0.5 0.7965 0.1677
47 5 0.5 0.5166 0.0513
48 6 0.5 0.8265 0.7008
49 7 0.759 0.6895 0.5343
50 8 0.5 0.9554 0.9033
51 9 0.5 0.5468 0.4194
52 10 0.5 0.8516 0.3692
53 11 0.5 0.6898 0.2626
54 12 0.7112 0.5472 0.1216
55 1 0.7528 0.3826 0.8325
56 7 0.759 0.3105 0.0343
57 12 0.7112 0.4528 0.6216
58 1 0.2472 0.6174 0.3325
59 7 0.241 0.6895 0.5343
60 12 0.2888 0.5472 0.1216
X-ray density (g/cm cub.) = 2.99
MU (1/cm) = 85.069 Mass attenuation coefficient (cm**2/g) = 28.436
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Al 2.316 6
1.8798 7
1.8938 9
1.8674 11
1.936 12
1.9143 6
1.8488 8
2 Al 2.316 5
1.7347 6
1.7666 7
1.8382 10
2.2038 11
1.7666 7
3 Al 2.316 5
2.2486 6
1.8025 10
1.72 8
1.8162 12
1.8162 12
4 Al 2.316 4
1.7458 10
1.7439 11
1.7154 7
1.7154 7
5 B 1.872 3
1.3866 12
1.3807 9
1.3866 12
6 O 3.264 10
2.813 7
2.4637 8
2.5647 10
2.813 7
2.9028 7
2.877 11
2.877 11
2.5607 12
2.9028 7
2.5607 12
7 O 3.264 10
2.813 6
2.723 9
3.0893 10
2.5432 11
2.7257 7
2.9293 7
2.9028 6
2.7383 8
2.9661 10
2.8507 11
8 O 3.264 10
2.4637 6
2.8798 10
2.7383 7
2.8304 9
2.8304 9
2.7047 12
2.7053 12
2.7383 7
2.7047 12
2.7053 12
9 O 3.264 9
2.723 7
2.4403 11
2.5728 12
2.4024 12
2.723 7
2.5728 12
2.4024 12
2.8304 8
2.8304 8
10 O 3.264 9
2.5647 6
3.0893 7
2.5389 11
2.8798 8
3.0893 7
2.9661 7
2.9426 12
2.9661 7
2.9426 12
11 O 3.264 10
2.5432 7
2.4403 9
2.5389 10
2.661 12
2.5432 7
2.661 12
2.877 6
2.877 6
2.8507 7
2.8507 7
12 O 3.264 8
2.5728 9
2.661 11
2.4024 9
2.3887 12
2.5607 6
2.7047 8
2.9426 10
2.7053 8
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 2 0 5.951 11.901 0.067 183.11 2 15.7 21.8
2 0 2 1 8.308 16.617 0.094 92.84 4 123.5 1370.4
3 1 1 0 8.38 16.76 0.095 91.22 4 51.3 232.7
4 1 1 1 10.202 20.405 0.115 60.83 8 75.5 671.3
5 0 0 2 11.615 23.229 0.131 46.46 2 54.1 65.7
6 1 3 0 11.931 23.861 0.134 43.92 4 67.7 194.8
7 0 4 0 11.967 23.933 0.135 43.64 2 11.5 2.8
8 0 2 2 13.088 26.177 0.147 36.15 4 53.4 99.8
9 1 3 1 13.293 26.586 0.149 34.98 8 17.8 21.5
10 0 4 1 13.326 26.652 0.15 34.8 4 115.9 452.0
11 1 1 2 14.391 28.783 0.161 29.55 8 18.9 20.5
12 2 0 0 15.809 31.617 0.177 24.16 2 81.2 77.0
13 1 3 2 16.772 33.544 0.187 21.26 8 36.6 55.0
14 0 4 2 16.798 33.597 0.188 21.18 4 150.2 462.2
15 2 2 0 16.947 33.894 0.189 20.78 4 35.2 24.8
16 1 5 0 17.025 34.05 0.19 20.57 4 23.5 11.0
17 2 2 1 17.961 35.923 0.2 18.3 8 88.7 278.8
18 1 5 1 18.036 36.072 0.201 18.14 8 40.2 56.8
19 0 6 0 18.12 36.241 0.202 17.95 2 7.1 0.4
20 0 2 3 18.62 37.24 0.207 16.91 4 54.1 47.9
21 0 6 1 19.081 38.161 0.212 16.02 4 17.7 4.8
22 1 1 3 19.592 39.184 0.218 15.11 8 50.2 73.7
23 2 0 2 19.8 39.601 0.22 14.76 4 37.3 19.9
24 2 4 0 20.02 40.041 0.222 14.4 4 114.8 183.5
25 2 2 2 20.748 41.495 0.23 13.3 8 106.3 290.7
26 1 5 2 20.814 41.628 0.231 13.21 8 39.8 40.4
27 2 4 1 20.907 41.813 0.232 13.08 8 55.9 79.1
28 1 3 3 21.467 42.935 0.238 12.32 8 29.3 20.4
29 0 4 3 21.489 42.978 0.238 12.3 4 145.1 250.4
30 0 6 2 21.746 43.492 0.24 11.97 4 48.4 27.1
31 1 7 0 22.804 45.607 0.252 10.76 4 33.8 11.9
32 2 4 2 23.401 46.802 0.258 10.14 8 49.0 47.1
33 1 7 1 23.605 47.211 0.26 9.95 8 31.7 19.3
34 0 0 4 23.744 47.489 0.261 9.82 2 66.4 21.0
35 3 1 0 24.325 48.65 0.267 9.29 4 65.5 38.6
36 2 6 0 24.422 48.844 0.268 9.21 4 4.2 0.2
37 0 8 0 24.5 48.999 0.269 9.14 2 65.6 19.1
38 0 2 4 24.569 49.138 0.27 9.08 4 69.9 42.9
39 2 2 3 24.817 49.633 0.272 8.88 8 14.2 3.4
40 1 5 3 24.874 49.748 0.273 8.83 8 103.9 184.6
41 3 1 1 25.089 50.179 0.275 8.66 8 63.5 67.6
42 2 6 1 25.184 50.369 0.276 8.59 8 74.4 91.9
43 0 8 1 25.26 50.52 0.277 8.53 4 56.3 26.2
44 1 1 4 25.355 50.709 0.278 8.45 8 12.0 2.4
45 0 6 3 25.69 51.381 0.281 8.21 4 59.8 28.4
46 1 7 2 25.896 51.793 0.283 8.06 8 60.1 56.4
47 3 3 0 25.927 51.854 0.284 8.04 4 15.0 1.8
48 3 3 1 26.658 53.316 0.291 7.54 8 33.6 16.4
49 1 3 4 26.912 53.824 0.294 7.38 8 61.0 53.2
50 0 4 4 26.93 53.86 0.294 7.37 4 70.5 35.4
51 2 4 3 27.162 54.325 0.296 7.23 8 32.8 15.1
52 3 1 2 27.289 54.578 0.298 7.15 8 31.8 14.0
53 2 6 2 27.379 54.757 0.299 7.1 8 101.4 141.2
54 0 8 2 27.45 54.9 0.299 7.06 4 100.1 68.5
55 3 3 2 28.774 57.547 0.312 6.34 8 22.3 6.1
56 3 5 0 28.94 57.881 0.314 6.26 4 21.3 2.7
57 1 9 0 29.078 58.156 0.315 6.19 4 21.0 2.6
58 2 0 4 29.088 58.176 0.316 6.19 4 123.3 91.0
59 1 7 3 29.429 58.857 0.319 6.03 8 14.9 2.6
60 3 5 1 29.621 59.242 0.321 5.94 8 60.7 42.4
61 2 8 0 29.747 59.493 0.322 5.88 4 65.2 24.2
62 1 9 1 29.757 59.513 0.322 5.88 8 49.8 28.2
63 2 2 4 29.807 59.615 0.323 5.86 8 31.0 10.9
64 1 5 4 29.858 59.716 0.323 5.84 8 53.5 32.4
65 2 8 1 30.416 60.832 0.329 5.6 8 40.2 17.5
66 0 6 4 30.583 61.166 0.33 5.53 4 28.3 4.3
67 3 1 3 30.714 61.428 0.332 5.48 8 47.7 24.1
68 2 6 3 30.797 61.594 0.332 5.45 8 171.5 309.9
69 0 8 3 30.864 61.727 0.333 5.42 4 74.0 28.7
70 0 2 5 30.923 61.846 0.334 5.4 4 40.2 8.5
71 0 10 0 31.222 62.444 0.336 5.28 2 34.7 3.1
72 1 1 5 31.601 63.201 0.34 5.15 8 52.5 27.4
73 3 5 2 31.608 63.217 0.34 5.14 8 33.8 11.3
74 1 9 2 31.739 63.478 0.341 5.1 8 23.9 5.7
75 0 10 1 31.873 63.746 0.343 5.05 4 33.3 5.4
76 2 4 4 31.906 63.812 0.343 5.04 8 59.2 34.2
77 3 3 3 32.099 64.198 0.345 4.97 8 36.0 12.5
78 2 8 2 32.375 64.75 0.348 4.88 8 110.5 115.4
79 1 3 5 32.965 65.929 0.353 4.7 8 16.2 2.4
80 0 4 5 32.981 65.961 0.353 4.69 4 46.5 9.8
81 4 0 0 33.014 66.029 0.354 4.68 2 269.8 164.8
82 3 7 0 33.126 66.252 0.355 4.65 4 45.2 9.2
83 4 2 0 33.685 67.37 0.36 4.49 4 24.2 2.5
84 3 7 1 33.757 67.515 0.361 4.47 8 1.8 0.0
85 0 10 2 33.785 67.571 0.361 4.46 4 82.4 29.3
86 1 7 4 33.978 67.957 0.363 4.4 8 23.6 4.7
87 4 2 1 34.311 68.622 0.366 4.32 8 65.7 36.0
88 3 5 3 34.778 69.556 0.37 4.2 8 78.0 49.5
89 1 9 3 34.903 69.805 0.371 4.17 8 11.1 1.0
90 3 1 4 35.171 70.343 0.374 4.1 8 13.3 1.4
91 2 6 4 35.249 70.498 0.375 4.09 8 61.4 29.8
92 0 8 4 35.311 70.621 0.375 4.07 4 73.2 21.1
93 2 8 3 35.51 71.02 0.377 4.03 8 1.5 0.0
94 4 0 2 35.511 71.021 0.377 4.03 4 30.6 3.7
95 2 2 5 35.565 71.131 0.378 4.01 8 141.4 155.4
96 1 5 5 35.612 71.223 0.378 4.0 8 54.1 22.7
97 3 7 2 35.619 71.238 0.378 4.0 8 56.4 24.6
98 4 4 0 35.66 71.319 0.378 3.99 4 1.8 0.0
99 2 10 0 35.844 71.689 0.38 3.95 4 75.9 22.0
100 1 11 0 35.89 71.781 0.381 3.94 4 36.4 5.1
101 4 2 2 36.159 72.319 0.383 3.89 8 41.3 12.8
102 4 4 1 36.27 72.541 0.384 3.86 8 59.9 26.9
103 0 6 5 36.275 72.55 0.384 3.86 4 80.0 23.9
104 2 10 1 36.454 72.908 0.386 3.83 8 70.3 36.6
105 3 3 4 36.469 72.938 0.386 3.82 8 47.0 16.3
106 1 11 1 36.5 72.999 0.386 3.82 8 81.9 49.5
107 0 10 3 36.864 73.727 0.389 3.75 4 87.7 27.9
108 0 0 6 37.156 74.311 0.392 3.69 2 119.5 25.5
109 2 4 5 37.497 74.994 0.395 3.63 8 62.6 27.5
110 0 2 6 37.793 75.587 0.398 3.58 4 60.5 12.7
111 4 4 2 38.079 76.159 0.4 3.53 8 99.8 68.1
112 2 10 2 38.26 76.52 0.402 3.5 8 114.8 89.3
113 1 11 2 38.305 76.61 0.402 3.49 8 32.8 7.3
114 3 9 0 38.329 76.659 0.403 3.49 4 39.1 5.2
115 1 1 6 38.412 76.825 0.403 3.48 8 56.6 21.6
116 0 12 0 38.465 76.929 0.404 3.47 2 98.6 16.3
117 3 7 3 38.636 77.273 0.405 3.44 8 13.9 1.3
118 4 6 0 38.856 77.712 0.407 3.41 4 7.8 0.2
119 3 9 1 38.925 77.85 0.408 3.4 8 48.3 15.3
120 3 5 4 39.014 78.029 0.409 3.39 8 49.6 16.1
121 0 12 1 39.059 78.118 0.409 3.38 4 82.7 22.4
122 1 9 4 39.134 78.267 0.41 3.37 8 27.1 4.8
123 4 2 3 39.162 78.323 0.41 3.37 8 57.7 21.7
124 1 7 5 39.439 78.877 0.412 3.33 8 11.6 0.9
125 4 6 1 39.449 78.898 0.412 3.33 8 32.2 6.7
126 1 3 6 39.671 79.343 0.414 3.3 8 31.8 6.5
127 0 4 6 39.686 79.372 0.415 3.29 4 37.1 4.4
128 2 8 4 39.717 79.433 0.415 3.29 8 29.8 5.6
129 3 1 5 40.571 81.141 0.422 3.19 8 47.6 14.0
130 2 6 5 40.645 81.289 0.423 3.18 8 47.9 14.1
131 3 9 2 40.696 81.392 0.423 3.17 8 19.1 2.2
132 0 8 5 40.704 81.407 0.423 3.17 4 31.7 3.1
133 0 12 2 40.829 81.657 0.424 3.16 4 34.9 3.7
134 0 10 4 41.024 82.048 0.426 3.14 4 8.7 0.2
135 4 4 3 41.037 82.074 0.426 3.13 8 79.6 38.4
136 2 10 3 41.214 82.427 0.428 3.12 8 41.0 10.1
137 4 6 2 41.215 82.429 0.428 3.12 8 36.1 7.9
138 1 11 3 41.258 82.516 0.428 3.11 8 5.3 0.2
139 2 0 6 41.497 82.994 0.43 3.09 4 66.8 13.3
140 3 3 5 41.813 83.627 0.433 3.06 8 23.9 3.4
141 2 2 6 42.117 84.233 0.435 3.03 8 48.8 14.0
142 1 5 6 42.161 84.321 0.436 3.02 8 40.4 9.5
143 4 0 4 42.648 85.296 0.44 2.98 4 48.9 6.9
144 3 7 4 42.75 85.501 0.441 2.97 8 8.5 0.4
145 2 12 0 42.771 85.542 0.441 2.97 4 40.8 4.8
146 0 6 6 42.793 85.587 0.441 2.97 4 35.6 3.6
147 5 1 0 43.081 86.162 0.443 2.95 4 20.2 1.2
148 4 8 0 43.213 86.425 0.444 2.94 4 23.8 1.6
149 4 2 4 43.265 86.53 0.445 2.93 8 32.5 6.0
150 2 12 1 43.353 86.706 0.446 2.93 8 9.7 0.5
151 1 13 0 43.432 86.864 0.446 2.92 4 8.7 0.2
152 3 9 3 43.614 87.229 0.448 2.91 8 10.4 0.6
153 5 1 1 43.662 87.325 0.448 2.91 8 33.6 6.4
154 0 12 3 43.746 87.492 0.449 2.9 4 39.7 4.4
155 4 8 1 43.794 87.588 0.449 2.9 8 32.6 6.0
156 2 4 6 43.969 87.937 0.451 2.89 8 72.4 29.3
157 1 13 1 44.013 88.027 0.451 2.88 8 29.8 5.0
158 4 6 3 44.128 88.257 0.452 2.88 8 30.3 5.1
159 3 5 5 44.283 88.566 0.453 2.87 8 27.0 4.0
160 5 3 0 44.314 88.628 0.453 2.87 4 46.6 6.0
161 1 9 5 44.4 88.8 0.454 2.86 8 24.8 3.4
162 3 11 0 44.548 89.095 0.455 2.85 4 54.7 8.2
163 5 3 1 44.895 89.789 0.458 2.83 8 8.8 0.4
164 2 8 5 44.972 89.944 0.459 2.83 8 28.1 4.3
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 2 0 5.951 11.901 7.43 21.8 1.6 1.6 5.6
2 0 2 1 8.308 16.617 5.33056 1370.4 100.0 100.0 5.6
3 1 1 0 8.38 16.76 5.28523 232.7 17.0 17.0 5.6
4 1 1 1 10.202 20.405 4.34875 671.3 49.0 48.9 5.6
5 0 0 2 11.615 23.229 3.826 65.7 4.8 4.8 5.6
6 1 3 0 11.931 23.861 3.72606 194.8 14.2 14.1 5.6
7 0 2 2 13.088 26.177 3.40151 99.8 7.3 7.2 5.6
8 1 3 1 13.293 26.586 3.35001 21.5 1.6 1.6 5.6
9 0 4 1 13.326 26.652 3.34196 452.0 33.0 32.8 5.6
10 1 1 2 14.391 28.783 3.09918 20.5 1.5 1.5 5.6
11 2 0 0 15.809 31.617 2.8275 77.0 5.6 5.6 5.6
12 0 4 2 16.798 33.597 2.66528 517.1 37.7 37.3 5.7
13 2 2 0 16.947 33.894 2.64262 24.8 1.8 1.8 5.7
14 2 2 1 17.961 35.923 2.49786 278.8 20.3 20.0 5.7
15 1 5 1 18.036 36.072 2.48787 56.8 4.1 4.1 5.7
16 0 2 3 18.62 37.24 2.41247 47.9 3.5 3.4 5.7
17 1 1 3 19.592 39.184 2.29715 73.7 5.4 5.3 5.7
18 2 0 2 19.8 39.601 2.27393 19.9 1.5 1.4 5.7
19 2 4 0 20.02 40.041 2.24995 183.5 13.4 13.1 5.7
20 2 2 2 20.748 41.495 2.17437 290.7 21.2 20.8 5.7
21 1 5 2 20.814 41.628 2.16778 40.4 3.0 2.9 5.7
22 2 4 1 20.907 41.813 2.15857 79.1 5.8 5.7 5.7
23 0 4 3 21.489 42.978 2.10275 270.8 19.8 19.3 5.7
24 0 6 2 21.746 43.492 2.07908 27.1 2.0 1.9 5.7
25 2 4 2 23.401 46.802 1.93945 47.1 3.4 3.3 5.7
26 1 7 1 23.605 47.211 1.92361 19.3 1.4 1.4 5.7
27 0 0 4 23.744 47.489 1.913 21.0 1.5 1.5 5.7
28 3 1 0 24.325 48.65 1.87001 38.6 2.8 2.7 5.7
29 0 8 0 24.5 48.999 1.8575 19.1 1.4 1.4 5.7
30 0 2 4 24.569 49.138 1.85258 42.9 3.1 3.0 5.7
31 1 5 3 24.874 49.748 1.83127 184.6 13.5 13.1 5.7
32 3 1 1 25.089 50.179 1.81656 67.6 4.9 4.8 5.7
33 2 6 1 25.184 50.369 1.81015 91.9 6.7 6.5 5.8
34 0 8 1 25.26 50.52 1.80508 26.2 1.9 1.9 5.8
35 0 6 3 25.69 51.381 1.77685 28.4 2.1 2.0 5.8
36 1 7 2 25.896 51.793 1.76368 56.4 4.1 4.0 5.8
37 3 3 1 26.658 53.316 1.71683 16.4 1.2 1.2 5.8
38 1 3 4 26.912 53.824 1.70181 88.6 6.5 6.2 5.8
39 2 4 3 27.162 54.325 1.68731 15.1 1.1 1.1 5.8
40 3 1 2 27.289 54.578 1.68007 14.0 1.0 1.0 5.8
41 2 6 2 27.379 54.757 1.675 141.2 10.3 9.9 5.8
42 0 8 2 27.45 54.9 1.67098 68.5 5.0 4.8 5.8
43 2 0 4 29.088 58.176 1.58443 93.7 6.8 6.6 5.8
44 3 5 1 29.621 59.242 1.55846 42.4 3.1 3.0 5.8
45 1 9 1 29.757 59.513 1.55199 52.4 3.8 3.7 5.8
46 1 5 4 29.858 59.716 1.5472 32.4 2.4 2.3 5.8
47 2 8 1 30.416 60.832 1.52147 17.5 1.3 1.2 5.8
48 3 1 3 30.714 61.428 1.50812 24.1 1.8 1.7 5.8
49 2 6 3 30.797 61.594 1.50445 309.9 22.6 21.6 5.8
50 0 8 3 30.864 61.727 1.50154 28.7 2.1 2.0 5.8
51 1 1 5 31.601 63.201 1.47001 38.8 2.8 2.7 5.9
52 2 4 4 31.906 63.812 1.45742 34.2 2.5 2.4 5.9
53 2 8 2 32.375 64.75 1.43855 115.4 8.4 8.0 5.9
54 4 0 0 33.014 66.029 1.41375 164.8 12.0 11.4 5.9
55 0 10 2 33.785 67.571 1.38519 29.3 2.1 2.0 5.9
56 4 2 1 34.311 68.622 1.36651 36.0 2.6 2.5 5.9
57 3 5 3 34.778 69.556 1.35042 49.5 3.6 3.4 5.9
58 2 6 4 35.249 70.498 1.33468 29.8 2.2 2.0 5.9
59 0 8 4 35.311 70.621 1.33264 21.1 1.5 1.4 5.9
60 2 2 5 35.565 71.131 1.32435 155.4 11.3 10.7 5.9
61 3 7 2 35.619 71.238 1.32262 47.3 3.5 3.2 5.9
62 2 10 0 35.844 71.689 1.3154 22.0 1.6 1.5 5.9
63 4 4 1 36.27 72.541 1.30204 50.8 3.7 3.5 5.9
64 2 10 1 36.454 72.908 1.29639 52.9 3.9 3.6 6.0
65 1 11 1 36.5 72.999 1.29499 49.5 3.6 3.4 6.0
66 0 10 3 36.864 73.727 1.28399 27.9 2.0 1.9 6.0
67 0 0 6 37.156 74.311 1.27533 25.5 1.9 1.7 6.0
68 2 4 5 37.497 74.994 1.26542 27.5 2.0 1.9 6.0
69 4 4 2 38.079 76.159 1.24893 68.1 5.0 4.6 6.0
70 2 10 2 38.26 76.52 1.24394 89.3 6.5 6.1 6.0
71 1 1 6 38.412 76.825 1.23975 21.6 1.6 1.5 6.0
72 0 12 0 38.465 76.929 1.23833 16.3 1.2 1.1 6.0
73 3 9 1 38.925 77.85 1.22598 15.3 1.1 1.0 6.0
74 3 5 4 39.014 78.029 1.22361 16.1 1.2 1.1 6.0
75 0 12 1 39.059 78.118 1.22243 22.4 1.6 1.5 6.0
76 4 2 3 39.162 78.323 1.21974 26.5 1.9 1.8 6.0
77 3 1 5 40.571 81.141 1.18434 14.0 1.0 0.9 6.1
78 2 6 5 40.645 81.289 1.18256 14.1 1.0 0.9 6.1
79 4 4 3 41.037 82.074 1.17323 38.4 2.8 2.6 6.1
80 2 10 3 41.214 82.427 1.16909 18.0 1.3 1.2 6.1
81 2 2 6 42.117 84.233 1.14857 14.0 1.0 0.9 6.1
82 2 4 6 43.969 87.937 1.10949 29.3 2.1 1.9 6.2
Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)
|