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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PYROSTILPNITE
1, t-pyrostilpnite, f-proustite, g-xanthoconite
Ag(3)SbS(3)
Monoclinic P 2(1)/c Z = 4
P2(1)/c
20 .5 .1988
Ref.Str.:
Kutoglu A. (1968)
* Neues Jb. Miner., Mh., 145-160
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 6.84 alpha = 90.0
b = 15.84 beta = 117.15
c = 6.24 gamma = 90.0
Unit cell volume (cub. angs.) = 601.58
Molar volume ( cub.cm/mol.) = 90.59
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.1972 0.0522 0.3749 0.0 Sb = 1.00
2 0.0358 0.3147 0.2658 0.0 Ag = 1.00
3 0.4698 0.2413 0.2804 0.0 Ag = 1.00
4 0.5962 0.0934 0.0528 0.0 Ag = 1.00
5 0.221 0.057 0.99 0.0 S = 1.00
6 0.541 0.135 0.592 0.0 S = 1.00
7 0.951 0.167 0.325 0.0 S = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.1972 0.0522 0.3749
2 2 0.0358 0.3147 0.2658
3 3 0.4698 0.2413 0.2804
4 4 0.5962 0.0934 0.0528
5 5 0.221 0.057 0.99
6 6 0.541 0.135 0.592
7 7 0.951 0.167 0.325
8 1 0.8028 0.5522 0.1251
9 2 0.9642 0.8147 0.2342
10 3 0.5302 0.7413 0.2196
11 4 0.4038 0.5934 0.4472
12 5 0.779 0.557 0.51
13 6 0.459 0.635 0.908
14 7 0.049 0.667 0.175
15 1 0.1972 0.4478 0.8749
16 2 0.0358 0.1853 0.7658
17 3 0.4698 0.2587 0.7804
18 4 0.5962 0.4066 0.5528
19 5 0.221 0.443 0.49
20 6 0.541 0.365 0.092
21 7 0.951 0.333 0.825
22 1 0.8028 0.9478 0.6251
23 2 0.9642 0.6853 0.7342
24 3 0.5302 0.7587 0.7196
25 4 0.4038 0.9066 0.9472
26 5 0.779 0.943 0.01
27 6 0.459 0.865 0.408
28 7 0.049 0.833 0.675
X-ray density (g/cm cub.) = 5.98
MU (1/cm) = 1236.071 Mass attenuation coefficient (cm**2/g) = 206.797
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Sb 3.264 4
2.4815 5
2.4855 6
2.4002 7
3.2272 5
2 Ag 3.54 4
2.4783 7
2.4647 5
3.1489 6
2.5554 7
3 Ag 3.54 4
3.4479 5
2.4472 6
3.3853 7
2.4456 6
4 Ag 3.54 4
2.4808 5
2.8025 6
2.5242 7
2.7595 5
5 S 4.368 9
3.5951 6
4.1769 6
4.3343 6
3.7868 7
4.0831 7
4.1724 5
3.5722 5
3.8507 6
3.9657 7
6 S 4.368 8
4.3343 5
4.1769 5
3.5951 5
4.1636 7
3.8938 7
3.6308 7
4.0117 7
3.8507 5
7 S 4.368 9
4.0831 5
3.7868 5
3.6308 6
3.8938 6
4.1636 6
4.0117 6
4.0802 7
4.0802 7
3.9657 5
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 5.581 11.163 0.063 208.46 2 73.0 613.7
2 1 0 0 7.271 14.542 0.082 121.91 2 76.1 390.6
3 1 1 0 7.792 15.584 0.088 105.85 4 65.7 504.6
4 1 1 -1 8.452 16.904 0.095 89.64 4 45.5 205.0
5 0 1 1 8.453 16.907 0.095 89.61 4 26.7 70.7
6 1 2 0 9.184 18.369 0.104 75.58 4 33.4 93.3
7 1 2 -1 9.753 19.506 0.11 66.77 4 17.7 23.2
8 0 2 1 9.754 19.509 0.11 66.76 4 35.9 95.2
9 1 3 0 11.136 22.271 0.125 50.72 4 42.9 103.2
10 0 4 0 11.216 22.433 0.126 49.97 2 11.4 3.6
11 1 3 -1 11.613 23.226 0.131 46.47 4 82.8 351.9
12 0 3 1 11.614 23.228 0.131 46.46 4 23.3 28.0
13 2 1 -1 13.39 26.781 0.15 34.44 4 122.0 566.6
14 1 1 1 13.393 26.786 0.15 34.43 4 179.2 1221.9
15 1 4 0 13.419 26.837 0.151 34.29 4 31.7 38.0
16 1 4 -1 13.822 27.644 0.155 32.2 4 291.5 3024.8
17 0 4 1 13.823 27.645 0.155 32.2 4 248.7 2201.6
18 2 2 -1 14.266 28.532 0.16 30.11 4 216.4 1558.4
19 1 2 1 14.268 28.537 0.16 30.1 4 183.8 1123.3
20 1 0 -2 14.293 28.586 0.16 29.98 2 395.4 2591.0
21 1 1 -2 14.574 29.148 0.163 28.77 4 20.2 12.9
22 2 0 0 14.662 29.324 0.164 28.4 2 254.2 1014.3
23 2 1 0 14.936 29.873 0.167 27.29 4 121.5 445.0
24 1 2 -2 15.388 30.776 0.172 25.6 4 198.8 1118.0
25 2 3 -1 15.626 31.251 0.175 24.77 4 200.0 1095.7
26 1 3 1 15.628 31.256 0.175 24.77 4 127.4 444.1
27 2 2 0 15.733 31.467 0.176 24.41 4 387.4 4048.5
28 1 5 0 15.909 31.818 0.178 23.83 4 223.2 1311.8
29 2 0 -2 16.106 32.211 0.18 23.21 2 243.8 762.1
30 0 0 2 16.108 32.217 0.18 23.2 2 137.8 243.5
31 1 5 -1 16.256 32.511 0.182 22.75 4 102.1 261.9
32 0 5 1 16.256 32.513 0.182 22.74 4 134.5 454.8
33 2 1 -2 16.358 32.716 0.183 22.44 4 98.7 241.6
34 0 1 2 16.361 32.722 0.183 22.43 4 89.9 200.5
35 1 3 -2 16.664 33.329 0.186 21.55 4 200.7 960.0
36 0 6 0 16.964 33.928 0.189 20.74 2 198.0 449.3
37 2 3 0 16.987 33.973 0.19 20.68 4 288.7 1904.4
38 2 2 -2 17.095 34.191 0.191 20.39 4 146.5 483.4
39 0 2 2 17.098 34.196 0.191 20.38 4 340.6 2614.3
40 2 4 -1 17.368 34.735 0.194 19.7 4 19.3 8.1
41 1 4 1 17.37 34.739 0.194 19.7 4 17.4 6.6
42 2 3 -2 18.266 36.532 0.203 17.64 4 125.6 307.6
43 0 3 2 18.269 36.537 0.203 17.64 4 41.5 33.6
44 1 4 -2 18.319 36.638 0.204 17.53 4 234.5 1065.4
45 1 6 0 18.544 37.089 0.206 17.06 4 370.4 2587.8
46 2 4 0 18.616 37.232 0.207 16.92 4 2.6 0.1
47 1 6 -1 18.848 37.697 0.21 16.46 4 73.1 97.2
48 0 6 1 18.849 37.698 0.21 16.46 4 58.5 62.3
49 2 5 -1 19.405 38.81 0.216 15.44 4 162.2 448.9
50 1 5 1 19.407 38.814 0.216 15.43 4 119.3 242.7
51 2 4 -2 19.804 39.609 0.22 14.75 4 249.6 1016.1
52 0 4 2 19.807 39.613 0.22 14.75 4 206.0 691.8
53 3 1 -1 20.064 40.128 0.223 14.33 4 18.1 5.2
54 2 1 1 20.067 40.133 0.223 14.33 4 6.4 0.7
55 1 5 -2 20.274 40.548 0.225 14.0 4 45.4 31.9
56 2 5 0 20.547 41.095 0.228 13.59 4 61.4 56.6
57 3 2 -1 20.686 41.373 0.229 13.39 4 36.5 19.7
58 2 2 1 20.689 41.378 0.229 13.39 4 24.4 8.8
59 3 0 -2 20.704 41.409 0.229 13.36 2 64.0 30.2
60 1 0 2 20.709 41.418 0.23 13.36 2 86.1 54.7
61 3 1 -2 20.908 41.817 0.232 13.07 4 260.6 981.4
62 1 1 2 20.913 41.826 0.232 13.07 4 159.4 367.1
63 1 7 0 21.295 42.59 0.236 12.55 4 199.5 552.1
64 3 2 -2 21.511 43.022 0.238 12.27 4 34.5 16.2
65 1 2 2 21.515 43.031 0.238 12.26 4 76.3 79.0
66 1 7 -1 21.566 43.132 0.239 12.2 4 38.1 19.6
67 0 7 1 21.567 43.133 0.239 12.2 4 75.1 76.0
68 2 5 -2 21.647 43.294 0.239 12.1 4 1.2 0.0
69 0 5 2 21.649 43.298 0.239 12.09 4 184.3 454.1
70 2 6 -1 21.674 43.348 0.24 12.06 4 32.4 14.0
71 1 6 1 21.675 43.351 0.24 12.06 4 147.5 289.9
72 3 3 -1 21.692 43.383 0.24 12.04 4 75.1 75.0
73 2 3 1 21.694 43.389 0.24 12.04 4 73.3 71.5
74 2 1 -3 22.26 44.521 0.246 11.36 4 83.2 86.8
75 1 1 -3 22.262 44.524 0.246 11.36 4 33.8 14.4
76 3 0 0 22.314 44.627 0.246 11.3 2 128.7 103.4
77 1 6 -2 22.471 44.941 0.248 11.12 4 57.4 40.4
78 3 3 -2 22.486 44.973 0.248 11.1 4 121.6 181.4
79 1 3 2 22.49 44.981 0.248 11.1 4 168.5 348.3
80 3 1 0 22.506 45.012 0.248 11.08 4 8.0 0.8
81 2 6 0 22.722 45.444 0.251 10.84 4 40.5 19.6
82 2 2 -3 22.834 45.669 0.252 10.72 4 54.2 34.8
83 1 2 -3 22.836 45.672 0.252 10.72 4 41.7 20.6
84 0 8 0 22.894 45.788 0.253 10.66 2 170.6 171.4
85 3 4 -1 23.039 46.079 0.254 10.51 4 127.5 188.7
86 2 4 1 23.042 46.084 0.254 10.51 4 35.0 14.2
87 3 2 0 23.075 46.15 0.254 10.47 4 69.8 56.4
88 2 6 -2 23.741 47.482 0.261 9.82 4 49.0 26.1
89 0 6 2 23.743 47.486 0.261 9.82 4 122.5 162.8
90 2 3 -3 23.767 47.533 0.262 9.79 4 117.1 148.4
91 1 3 -3 23.768 47.536 0.262 9.79 4 80.3 69.7
92 3 4 -2 23.799 47.597 0.262 9.76 4 173.4 324.5
93 1 4 2 23.803 47.605 0.262 9.76 4 227.8 559.8
94 3 3 0 24.0 48.0 0.264 9.58 4 346.7 1272.7
95 2 7 -1 24.131 48.262 0.265 9.46 4 130.0 176.8
96 1 7 1 24.133 48.265 0.265 9.46 4 136.0 193.5
97 1 8 0 24.148 48.296 0.266 9.45 4 355.3 1317.7
98 1 8 -1 24.395 48.789 0.268 9.23 4 87.1 77.4
99 0 8 1 24.395 48.79 0.268 9.23 4 45.4 21.0
100 3 5 -1 24.688 49.375 0.271 8.98 4 64.6 41.4
101 2 5 1 24.69 49.38 0.271 8.98 4 84.1 70.3
102 3 1 -3 24.768 49.536 0.272 8.92 4 184.2 334.3
103 0 1 3 24.772 49.545 0.272 8.91 4 208.2 426.9
104 1 7 -2 24.867 49.733 0.273 8.84 4 139.1 189.0
105 2 4 -3 25.027 50.055 0.275 8.71 4 289.9 809.2
106 1 4 -3 25.029 50.058 0.275 8.71 4 308.4 915.5
107 2 7 0 25.1 50.2 0.275 8.65 4 48.0 22.0
108 3 4 0 25.252 50.504 0.277 8.53 4 157.8 235.0
109 3 2 -3 25.298 50.596 0.277 8.5 4 248.3 579.2
110 0 2 3 25.302 50.605 0.277 8.49 4 199.6 374.2
111 3 5 -2 25.41 50.819 0.279 8.41 4 304.5 862.0
112 1 5 2 25.413 50.827 0.279 8.41 4 65.8 40.3
113 2 7 -2 26.048 52.096 0.285 7.95 4 211.6 393.6
114 0 7 2 26.05 52.1 0.285 7.95 4 196.3 338.6
115 3 3 -3 26.164 52.329 0.286 7.87 4 139.3 168.7
116 0 3 3 26.169 52.337 0.286 7.87 4 42.5 15.7
117 2 5 -3 26.583 53.167 0.29 7.59 4 46.3 18.0
118 1 5 -3 26.585 53.169 0.29 7.59 4 94.8 75.3
119 3 6 -1 26.598 53.196 0.291 7.58 4 244.4 500.6
120 2 6 1 26.6 53.201 0.291 7.58 4 165.3 228.9
121 2 8 -1 26.752 53.503 0.292 7.48 4 42.9 15.2
122 1 8 1 26.753 53.506 0.292 7.48 4 172.6 246.3
123 3 5 0 26.799 53.598 0.293 7.45 4 54.0 24.0
124 4 0 -2 26.926 53.853 0.294 7.37 2 49.9 10.1
125 2 0 2 26.932 53.864 0.294 7.37 2 259.6 274.5
126 4 1 -2 27.094 54.188 0.296 7.27 4 139.3 155.9
127 2 1 2 27.099 54.198 0.296 7.27 4 56.2 25.4
128 1 9 0 27.103 54.206 0.296 7.26 4 72.0 41.6
129 3 6 -2 27.284 54.567 0.298 7.15 4 133.8 141.6
130 1 6 2 27.287 54.574 0.298 7.15 4 266.0 559.3
131 1 9 -1 27.33 54.66 0.298 7.13 4 67.8 36.2
132 0 9 1 27.33 54.661 0.298 7.13 4 119.2 111.8
133 3 4 -3 27.344 54.688 0.298 7.12 4 88.5 61.6
134 0 4 3 27.348 54.696 0.298 7.12 4 81.2 51.9
135 1 8 -2 27.436 54.872 0.299 7.06 4 329.8 849.5
136 4 1 -1 27.54 55.081 0.3 7.0 4 223.4 386.3
137 3 1 1 27.544 55.087 0.3 7.0 4 215.9 360.6
138 4 2 -2 27.592 55.184 0.301 6.97 4 228.8 403.4
139 2 2 2 27.597 55.194 0.301 6.97 4 247.1 470.5
140 2 8 0 27.654 55.307 0.301 6.94 4 135.2 140.1
141 4 2 -1 28.033 56.067 0.305 6.73 4 177.0 233.1
142 3 2 1 28.036 56.073 0.305 6.73 4 152.3 172.4
143 2 6 -3 28.403 56.807 0.309 6.53 4 32.5 7.6
144 1 6 -3 28.405 56.809 0.309 6.53 4 8.5 0.5
145 4 3 -2 28.409 56.818 0.309 6.53 4 44.0 14.0
146 2 3 2 28.414 56.829 0.309 6.52 4 274.1 541.8
147 2 8 -2 28.542 57.085 0.31 6.46 4 172.2 211.7
148 0 8 2 28.544 57.088 0.31 6.46 4 4.4 0.1
149 3 6 0 28.61 57.219 0.311 6.42 4 217.2 334.9
150 3 7 -1 28.74 57.48 0.312 6.36 4 4.9 0.2
151 2 7 1 28.742 57.484 0.312 6.36 4 27.9 5.5
152 3 5 -3 28.813 57.625 0.313 6.32 4 111.7 87.2
153 0 5 3 28.816 57.633 0.313 6.32 4 81.3 46.2
154 4 3 -1 28.842 57.684 0.313 6.31 4 126.1 110.8
155 3 3 1 28.845 57.69 0.313 6.31 4 46.5 15.0
156 0 10 0 29.097 58.194 0.316 6.18 2 125.0 53.4
157 4 1 -3 29.305 58.61 0.318 6.09 4 3.1 0.1
158 1 1 3 29.311 58.622 0.318 6.08 4 62.4 26.2
159 3 7 -2 29.392 58.784 0.319 6.04 4 54.3 19.7
160 1 7 2 29.396 58.791 0.319 6.04 4 7.4 0.4
161 2 9 -1 29.522 59.044 0.32 5.99 4 42.1 11.7
162 1 9 1 29.523 59.047 0.32 5.98 4 63.6 26.8
163 4 4 -2 29.528 59.057 0.32 5.98 4 36.7 8.9
164 2 4 2 29.533 59.067 0.32 5.98 4 53.2 18.7
165 2 0 -4 29.589 59.177 0.321 5.95 2 336.5 372.5
166 2 1 -4 29.746 59.492 0.322 5.88 4 186.7 226.8
167 4 2 -3 29.779 59.557 0.322 5.87 4 45.6 13.5
168 1 2 3 29.785 59.57 0.322 5.87 4 92.0 54.9
169 4 4 -1 29.951 59.902 0.324 5.79 4 51.9 17.3
170 3 4 1 29.954 59.908 0.324 5.79 4 54.5 19.0
171 1 10 0 30.165 60.329 0.326 5.7 4 37.9 9.1
172 1 9 -2 30.165 60.33 0.326 5.7 4 30.3 5.8
173 2 2 -4 30.216 60.431 0.327 5.68 4 15.2 1.5
174 2 9 0 30.37 60.74 0.328 5.62 4 152.5 144.4
175 1 10 -1 30.377 60.753 0.328 5.61 4 10.0 0.6
176 0 10 1 30.377 60.754 0.328 5.61 4 89.1 49.3
177 4 0 0 30.413 60.827 0.329 5.6 2 164.0 83.2
178 2 7 -3 30.462 60.923 0.329 5.58 4 68.2 28.7
179 1 7 -3 30.463 60.926 0.329 5.58 4 39.7 9.7
180 3 6 -3 30.545 61.09 0.33 5.55 4 32.7 6.6
181 0 6 3 30.549 61.098 0.33 5.54 4 119.6 87.7
182 4 3 -3 30.558 61.116 0.33 5.54 4 107.0 70.1
183 1 3 3 30.564 61.129 0.33 5.54 4 18.4 2.1
184 4 1 0 30.568 61.137 0.33 5.54 4 7.6 0.4
185 3 0 -4 30.644 61.288 0.331 5.51 2 48.1 7.1
186 1 0 -4 30.648 61.295 0.331 5.51 2 92.7 26.1
187 3 7 0 30.659 61.318 0.331 5.5 4 21.0 2.7
188 3 1 -4 30.798 61.597 0.332 5.45 4 147.0 130.0
189 1 1 -4 30.802 61.604 0.332 5.44 4 95.9 55.4
190 4 5 -2 30.93 61.86 0.334 5.39 4 159.1 151.0
191 2 5 2 30.935 61.87 0.334 5.39 4 157.0 146.9
192 2 3 -4 30.989 61.978 0.334 5.37 4 9.3 0.5
193 4 2 0 31.03 62.061 0.335 5.36 4 138.9 114.3
194 3 8 -1 31.091 62.183 0.335 5.33 4 150.0 132.7
195 2 8 1 31.093 62.187 0.335 5.33 4 231.8 316.7
196 2 9 -2 31.21 62.419 0.336 5.29 4 5.4 0.2
197 0 9 2 31.211 62.423 0.336 5.29 4 75.2 33.1
198 3 2 -4 31.259 62.517 0.337 5.27 4 4.1 0.1
199 1 2 -4 31.262 62.524 0.337 5.27 4 75.7 33.4
200 4 5 -1 31.342 62.683 0.338 5.24 4 48.0 13.3
201 3 5 1 31.344 62.689 0.338 5.24 4 0.9 0.0
202 4 4 -3 31.631 63.261 0.34 5.13 4 72.5 29.8
203 1 4 3 31.637 63.273 0.34 5.13 4 62.1 21.8
204 3 8 -2 31.714 63.428 0.341 5.11 4 88.8 44.5
205 1 8 2 31.717 63.435 0.341 5.1 4 108.8 66.8
206 4 3 0 31.792 63.584 0.342 5.08 4 17.7 1.8
207 3 3 -4 32.017 64.034 0.344 5.0 4 132.2 96.6
208 1 3 -4 32.02 64.041 0.344 5.0 4 67.4 25.1
209 2 4 -4 32.053 64.106 0.344 4.99 4 1.6 0.0
210 2 10 -1 32.44 64.88 0.348 4.86 4 170.2 155.7
211 1 10 1 32.441 64.883 0.348 4.86 4 51.6 14.3
212 3 7 -3 32.521 65.042 0.349 4.83 4 200.7 215.2
213 0 7 3 32.525 65.05 0.349 4.83 4 118.3 74.8
214 4 6 -2 32.595 65.191 0.35 4.81 4 34.7 6.4
215 2 6 2 32.6 65.2 0.35 4.81 4 24.7 3.2
216 2 8 -3 32.739 65.478 0.351 4.76 4 0.9 0.0
217 1 8 -3 32.74 65.481 0.351 4.76 4 5.2 0.1
218 4 4 0 32.842 65.683 0.352 4.73 4 131.7 90.7
219 3 8 0 32.929 65.858 0.353 4.71 4 103.8 56.1
220 4 5 -3 32.98 65.961 0.353 4.69 4 93.0 44.8
221 1 5 3 32.986 65.973 0.353 4.69 4 45.2 10.6
222 4 6 -1 32.995 65.991 0.353 4.69 4 51.1 13.5
223 3 6 1 32.998 65.996 0.354 4.69 4 133.8 92.6
224 1 10 -2 33.05 66.1 0.354 4.67 4 127.3 83.7
225 3 4 -4 33.063 66.126 0.354 4.67 4 83.9 36.3
226 1 4 -4 33.066 66.132 0.354 4.66 4 27.9 4.0
227 2 10 0 33.245 66.49 0.356 4.61 4 108.2 59.7
228 1 11 0 33.345 66.691 0.357 4.58 4 95.1 45.8
229 2 5 -4 33.394 66.787 0.357 4.57 4 137.3 95.2
230 1 11 -1 33.546 67.092 0.359 4.52 4 250.1 312.9
231 0 11 1 33.546 67.093 0.359 4.52 4 212.5 225.7
232 3 9 -1 33.639 67.279 0.36 4.5 4 95.3 45.2
233 2 9 1 33.641 67.283 0.36 4.5 4 10.6 0.6
234 4 0 -4 33.698 67.397 0.36 4.48 2 137.7 47.0
235 0 0 4 33.705 67.409 0.36 4.48 2 92.2 21.1
236 4 1 -4 33.845 67.69 0.362 4.44 4 1.8 0.0
237 0 1 4 33.851 67.703 0.362 4.44 4 230.6 260.9
238 2 10 -2 34.045 68.091 0.363 4.39 4 188.4 172.0
239 0 10 2 34.047 68.094 0.363 4.39 4 79.1 30.3
240 4 5 0 34.166 68.333 0.365 4.35 4 247.5 294.9
241 3 9 -2 34.237 68.474 0.365 4.34 4 46.7 10.4
242 1 9 2 34.24 68.481 0.365 4.33 4 112.2 60.4
243 5 0 -2 34.276 68.552 0.366 4.33 2 68.8 11.3
244 3 0 2 34.283 68.565 0.366 4.32 2 18.5 0.8
245 4 2 -4 34.283 68.566 0.366 4.32 4 40.9 8.0
246 0 2 4 34.289 68.578 0.366 4.32 4 215.5 221.8
247 3 5 -4 34.383 68.767 0.367 4.3 4 100.9 48.3
248 1 5 -4 34.387 68.773 0.367 4.3 4 25.6 3.1
249 5 1 -2 34.422 68.843 0.367 4.29 4 179.8 153.3
250 3 1 2 34.428 68.856 0.367 4.29 4 142.8 96.6
251 4 7 -2 34.508 69.015 0.368 4.27 4 226.5 241.9
252 2 7 2 34.512 69.025 0.368 4.26 4 94.6 42.2
253 4 6 -3 34.593 69.186 0.369 4.24 4 232.4 253.3
254 1 6 3 34.599 69.198 0.369 4.24 4 246.4 284.8
255 3 8 -3 34.726 69.451 0.37 4.21 4 63.9 19.0
256 0 8 3 34.729 69.458 0.37 4.21 4 21.7 2.2
257 5 2 -2 34.856 69.713 0.371 4.18 4 69.8 22.5
258 3 2 2 34.862 69.725 0.371 4.18 4 81.9 31.0
259 4 7 -1 34.897 69.794 0.371 4.17 4 97.6 43.9
260 3 7 1 34.9 69.799 0.371 4.17 4 96.1 42.6
261 2 6 -4 34.997 69.994 0.372 4.15 4 114.3 59.8
262 4 3 -4 35.007 70.014 0.372 4.14 4 266.2 324.4
263 0 3 4 35.013 70.027 0.372 4.14 4 22.6 2.3
264 2 9 -3 35.225 70.45 0.374 4.09 4 112.1 56.9
265 1 9 -3 35.226 70.452 0.374 4.09 4 235.2 250.3
266 5 1 -3 35.405 70.81 0.376 4.05 4 190.6 162.7
267 3 9 0 35.408 70.816 0.376 4.05 4 53.1 12.6
268 2 1 3 35.413 70.826 0.376 4.05 4 206.1 190.0
269 2 11 -1 35.511 71.023 0.377 4.03 4 2.4 0.0
270 1 11 1 35.512 71.025 0.377 4.03 4 38.7 6.7
271 5 3 -2 35.575 71.151 0.378 4.01 4 185.0 151.8
272 3 3 2 35.581 71.163 0.378 4.01 4 29.1 3.8
273 0 12 0 35.7 71.401 0.379 3.98 2 100.0 22.0
274 4 6 0 35.754 71.507 0.379 3.97 4 47.4 9.9
275 5 1 -1 35.785 71.569 0.38 3.97 4 13.2 0.8
276 4 1 1 35.788 71.576 0.38 3.96 4 49.4 10.7
277 5 2 -3 35.834 71.669 0.38 3.95 4 236.5 244.5
278 2 2 3 35.842 71.685 0.38 3.95 4 89.7 35.2
279 3 6 -4 35.966 71.932 0.381 3.93 4 135.4 79.5
280 1 6 -4 35.969 71.939 0.381 3.93 4 230.9 231.3
281 4 4 -4 36.01 72.021 0.382 3.92 4 33.6 4.9
282 0 4 4 36.016 72.033 0.382 3.92 4 54.7 12.9
283 1 11 -2 36.096 72.192 0.382 3.9 4 15.7 1.1
284 5 2 -1 36.212 72.424 0.383 3.87 4 1.7 0.0
285 4 2 1 36.216 72.431 0.384 3.87 4 43.3 8.0
286 2 11 0 36.283 72.567 0.384 3.86 4 39.6 6.7
287 3 10 -1 36.38 72.759 0.385 3.84 4 18.5 1.4
288 2 10 1 36.381 72.763 0.385 3.84 4 47.6 9.6
289 4 7 -3 36.456 72.911 0.386 3.83 4 66.1 18.5
290 1 7 3 36.461 72.923 0.386 3.82 4 58.5 14.5
291 5 3 -3 36.545 73.09 0.387 3.81 4 45.4 8.7
292 2 3 3 36.553 73.106 0.387 3.81 4 41.9 7.4
293 5 4 -2 36.572 73.143 0.387 3.8 4 1.2 0.0
294 3 4 2 36.578 73.156 0.387 3.8 4 35.0 5.2
295 4 8 -2 36.656 73.311 0.388 3.79 4 68.5 19.6
296 2 8 2 36.66 73.32 0.388 3.78 4 37.4 5.8
297 1 12 0 36.663 73.327 0.388 3.78 4 112.8 53.2
298 2 7 -4 36.851 73.702 0.389 3.75 4 50.6 10.6
299 1 12 -1 36.856 73.712 0.389 3.75 4 81.5 27.5
300 0 12 1 36.856 73.712 0.389 3.75 4 200.4 166.3
301 5 3 -1 36.92 73.84 0.39 3.73 4 23.1 2.2
302 4 3 1 36.923 73.847 0.39 3.73 4 56.5 13.2
303 3 10 -2 36.958 73.915 0.39 3.73 4 199.4 163.9
304 1 10 2 36.961 73.921 0.39 3.73 4 296.1 361.2
305 4 8 -1 37.035 74.07 0.391 3.71 4 38.8 6.2
306 3 8 1 37.038 74.076 0.391 3.71 4 150.7 93.2
307 2 11 -2 37.054 74.109 0.391 3.71 4 52.6 11.3
308 0 11 2 37.056 74.112 0.391 3.71 4 125.5 64.6
309 3 9 -3 37.15 74.3 0.392 3.69 4 0.6 0.0
310 0 9 3 37.153 74.307 0.392 3.69 4 72.0 21.2
311 4 5 -4 37.284 74.567 0.393 3.67 4 22.2 2.0
312 0 5 4 37.29 74.579 0.393 3.67 4 21.1 1.8
313 5 4 -3 37.532 75.063 0.395 3.62 4 29.5 3.5
314 2 4 3 37.539 75.079 0.396 3.62 4 35.6 5.1
315 4 7 0 37.592 75.185 0.396 3.61 4 45.0 8.1
316 3 7 -4 37.801 75.602 0.398 3.58 4 17.4 1.2
317 1 7 -4 37.804 75.608 0.398 3.58 4 263.6 274.6
318 5 5 -2 37.838 75.676 0.398 3.57 4 50.4 10.0
319 3 5 2 37.844 75.688 0.398 3.57 4 109.4 47.2
320 5 4 -1 37.903 75.806 0.399 3.56 4 174.2 119.5
321 4 4 1 37.906 75.812 0.399 3.56 4 135.6 72.4
322 2 10 -3 37.916 75.831 0.399 3.56 4 130.1 66.6
323 1 10 -3 37.917 75.834 0.399 3.56 4 14.0 0.8
324 3 10 0 38.094 76.188 0.4 3.53 4 277.5 300.3
325 3 1 -5 38.487 76.974 0.404 3.47 4 132.1 66.9
326 2 1 -5 38.489 76.978 0.404 3.47 4 53.1 10.8
327 5 0 -4 38.521 77.043 0.404 3.46 2 37.8 2.7
328 1 0 4 38.53 77.061 0.404 3.46 2 37.1 2.6
329 4 8 -3 38.56 77.12 0.405 3.45 4 200.6 153.6
330 1 8 3 38.566 77.131 0.405 3.45 4 141.5 76.5
331 5 1 -4 38.66 77.32 0.406 3.44 4 156.7 93.3
332 1 1 4 38.669 77.338 0.406 3.44 4 69.3 18.2
333 2 12 -1 38.751 77.501 0.406 3.43 4 195.2 144.2
334 1 12 1 38.752 77.504 0.406 3.43 4 103.5 40.6
335 5 5 -3 38.787 77.573 0.407 3.42 4 24.9 2.4
336 2 5 3 38.794 77.589 0.407 3.42 4 19.4 1.4
337 4 6 -4 38.819 77.638 0.407 3.42 4 12.2 0.6
338 0 6 4 38.825 77.65 0.407 3.42 4 11.0 0.5
339 3 2 -5 38.904 77.807 0.408 3.4 4 29.3 3.2
340 2 2 -5 38.905 77.811 0.408 3.4 4 74.8 21.0
341 2 8 -4 38.948 77.896 0.408 3.4 4 114.3 49.1
342 4 9 -2 39.033 78.067 0.409 3.38 4 61.0 13.9
343 2 9 2 39.038 78.076 0.409 3.38 4 17.6 1.2
344 5 2 -4 39.076 78.152 0.409 3.38 4 128.7 61.9
345 1 2 4 39.085 78.17 0.409 3.38 4 20.7 1.6
346 5 5 -1 39.154 78.308 0.41 3.37 4 178.2 118.2
347 4 5 1 39.157 78.315 0.41 3.37 4 198.6 146.8
348 5 0 0 39.257 78.513 0.411 3.35 2 229.4 97.5
349 3 11 -1 39.317 78.634 0.411 3.34 4 169.8 106.6
350 1 12 -2 39.318 78.636 0.411 3.34 4 59.2 13.0
351 2 11 1 39.319 78.638 0.411 3.34 4 71.8 19.1
352 5 6 -2 39.366 78.733 0.412 3.34 4 149.1 82.0
353 3 6 2 39.372 78.745 0.412 3.34 4 226.5 189.2
354 5 1 0 39.395 78.79 0.412 3.33 4 123.7 56.4
355 4 9 -1 39.405 78.81 0.412 3.33 4 69.4 17.7
356 3 9 1 39.408 78.816 0.412 3.33 4 134.3 66.4
357 2 12 0 39.5 79.0 0.413 3.32 4 208.6 159.7
358 3 3 -5 39.595 79.19 0.414 3.31 4 12.9 0.6
359 2 3 -5 39.597 79.193 0.414 3.31 4 101.0 37.3
360 4 8 0 39.676 79.353 0.414 3.3 4 33.6 4.1
361 5 3 -4 39.767 79.533 0.415 3.28 4 190.1 131.2
362 1 3 4 39.776 79.551 0.415 3.28 4 141.6 72.8
363 3 10 -3 39.793 79.587 0.415 3.28 4 96.6 33.8
364 0 10 3 39.797 79.594 0.415 3.28 4 197.1 140.9
365 5 2 0 39.809 79.617 0.416 3.28 4 186.5 126.1
366 3 11 -2 39.881 79.762 0.416 3.27 4 84.8 26.0
367 3 8 -4 39.882 79.764 0.416 3.27 4 188.1 127.8
368 1 11 2 39.884 79.768 0.416 3.27 4 36.5 4.8
369 1 8 -4 39.885 79.769 0.416 3.27 4 102.9 38.3
370 1 13 0 40.145 80.289 0.418 3.24 4 164.7 97.1
371 2 12 -2 40.25 80.501 0.419 3.22 4 32.4 3.7
372 0 12 2 40.252 80.504 0.419 3.22 4 76.2 20.7
373 5 6 -3 40.305 80.609 0.42 3.22 4 64.2 14.7
374 2 6 3 40.312 80.625 0.42 3.22 4 8.8 0.3
375 1 13 -1 40.332 80.663 0.42 3.21 4 18.3 1.2
376 0 13 1 40.332 80.664 0.42 3.21 4 27.2 2.6
377 4 1 -5 40.356 80.713 0.42 3.21 4 179.5 114.4
378 1 1 -5 40.362 80.724 0.42 3.21 4 106.9 40.6
379 5 3 0 40.496 80.992 0.422 3.19 4 140.6 69.8
380 3 4 -5 40.558 81.115 0.422 3.19 4 282.2 280.6
381 2 4 -5 40.559 81.119 0.422 3.19 4 180.7 115.0
382 4 7 -4 40.611 81.222 0.423 3.18 4 157.5 87.2
383 0 7 4 40.617 81.234 0.423 3.18 4 100.8 35.7
384 5 6 -1 40.668 81.337 0.423 3.17 4 3.9 0.1
385 4 6 1 40.672 81.344 0.423 3.17 4 80.9 22.9
386 5 4 -4 40.728 81.457 0.424 3.17 4 4.9 0.1
387 1 4 4 40.737 81.474 0.424 3.17 4 153.2 82.2
388 4 2 -5 40.768 81.535 0.424 3.16 4 151.2 79.9
389 1 2 -5 40.773 81.546 0.424 3.16 4 260.3 236.9
390 2 11 -3 40.818 81.636 0.424 3.16 4 130.4 59.3
391 1 11 -3 40.819 81.639 0.424 3.16 4 144.4 72.8
392 4 9 -3 40.904 81.807 0.425 3.15 4 39.4 5.4
393 1 9 3 40.909 81.818 0.425 3.15 4 16.8 1.0
394 3 11 0 40.993 81.986 0.426 3.14 4 18.7 1.2
395 5 7 -2 41.152 82.305 0.427 3.12 4 196.0 132.6
396 3 7 2 41.158 82.317 0.427 3.12 4 63.1 13.7
397 2 9 -4 41.286 82.571 0.428 3.11 4 123.5 52.4
398 4 3 -5 41.451 82.903 0.43 3.09 4 90.2 27.8
399 5 4 0 41.454 82.908 0.43 3.09 4 95.5 31.1
400 1 3 -5 41.457 82.914 0.43 3.09 4 25.7 2.3
401 4 10 -2 41.643 83.286 0.431 3.07 4 192.0 125.2
402 2 10 2 41.647 83.295 0.431 3.07 4 19.0 1.2
403 3 5 -5 41.788 83.576 0.433 3.06 4 127.0 54.5
404 2 5 -5 41.79 83.58 0.433 3.06 4 114.8 44.6
405 5 5 -4 41.958 83.916 0.434 3.04 4 50.4 8.6
406 1 5 4 41.967 83.933 0.434 3.04 4 196.8 130.1
407 4 9 0 42.005 84.01 0.434 3.04 4 187.4 117.9
408 4 10 -1 42.01 84.019 0.434 3.04 4 142.4 68.0
409 3 10 1 42.012 84.024 0.434 3.04 4 59.4 11.8
410 5 7 -3 42.082 84.164 0.435 3.03 4 46.5 7.2
411 2 7 3 42.09 84.179 0.435 3.03 4 176.7 104.6
412 2 13 -1 42.183 84.366 0.436 3.02 4 54.3 9.8
413 1 13 1 42.184 84.368 0.436 3.02 4 1.0 0.0
414 3 9 -4 42.208 84.416 0.436 3.02 4 152.0 77.1
415 1 9 -4 42.211 84.422 0.436 3.02 4 37.2 4.6
416 4 4 -5 42.405 84.811 0.438 3.0 4 150.4 75.1
417 1 4 -5 42.411 84.822 0.438 3.0 4 65.6 14.3
418 5 7 -1 42.443 84.886 0.438 3.0 4 14.7 0.7
419 4 7 1 42.446 84.892 0.438 3.0 4 37.5 4.7
420 3 12 -1 42.467 84.935 0.438 3.0 4 91.1 27.5
421 2 12 1 42.469 84.938 0.438 3.0 4 11.0 0.4
422 4 8 -4 42.658 85.316 0.44 2.98 4 65.9 14.3
423 0 8 4 42.664 85.328 0.44 2.98 4 29.6 2.9
424 3 11 -3 42.665 85.33 0.44 2.98 4 123.3 50.1
425 0 11 3 42.668 85.336 0.44 2.98 4 89.4 26.4
426 5 5 0 42.68 85.359 0.44 2.98 4 99.9 32.9
427 1 13 -2 42.74 85.48 0.441 2.97 4 101.8 34.1
428 6 0 -2 42.781 85.563 0.441 2.97 2 215.6 76.3
429 4 0 2 42.789 85.578 0.441 2.97 2 388.9 248.3
430 0 14 0 42.906 85.813 0.442 2.96 2 195.9 62.8
431 6 1 -2 42.917 85.835 0.442 2.96 4 69.3 15.7
432 2 13 0 42.919 85.838 0.442 2.96 4 16.0 0.8
433 6 1 -3 42.922 85.845 0.442 2.96 4 27.0 2.4
434 4 1 2 42.925 85.849 0.442 2.96 4 33.8 3.7
435 3 1 3 42.932 85.864 0.442 2.96 4 3.9 0.1
436 3 12 -2 43.023 86.046 0.443 2.95 4 6.8 0.1
437 1 12 2 43.026 86.052 0.443 2.95 4 58.8 11.3
438 5 8 -2 43.195 86.39 0.444 2.94 4 13.5 0.6
439 3 8 2 43.201 86.402 0.444 2.94 4 256.4 213.5
440 3 6 -5 43.284 86.568 0.445 2.93 4 30.2 3.0
441 2 6 -5 43.286 86.572 0.445 2.93 4 44.4 6.4
442 6 2 -2 43.325 86.649 0.445 2.93 4 120.1 46.7
443 6 2 -3 43.33 86.659 0.445 2.93 4 28.0 2.5
444 4 2 2 43.332 86.664 0.445 2.93 4 33.1 3.5
445 3 2 3 43.339 86.679 0.446 2.93 4 66.5 14.3
446 5 6 -4 43.453 86.907 0.446 2.92 4 31.0 3.1
447 1 6 4 43.462 86.924 0.447 2.92 4 129.7 54.3
448 4 10 -3 43.491 86.982 0.447 2.92 4 100.4 32.5
449 1 10 3 43.497 86.993 0.447 2.92 4 28.8 2.7
450 4 5 -5 43.628 87.256 0.448 2.91 4 147.9 70.3
451 1 5 -5 43.633 87.267 0.448 2.91 4 109.9 38.8
452 2 13 -2 43.659 87.318 0.448 2.91 4 212.4 145.0
453 0 13 2 43.66 87.321 0.448 2.91 4 78.0 19.5
454 1 14 0 43.826 87.651 0.449 2.9 4 21.8 1.5
455 2 10 -4 43.87 87.74 0.45 2.89 4 74.5 17.8
456 2 12 -3 43.949 87.898 0.45 2.89 4 228.0 165.9
457 1 12 -3 43.95 87.9 0.451 2.89 4 72.1 16.6
458 6 3 -2 44.003 88.006 0.451 2.88 4 16.3 0.8
459 6 3 -3 44.008 88.016 0.451 2.88 4 5.2 0.1
460 4 3 2 44.01 88.02 0.451 2.88 4 28.9 2.7
461 1 14 -1 44.01 88.021 0.451 2.88 4 42.7 5.8
462 0 14 1 44.011 88.022 0.451 2.88 4 115.2 42.3
463 3 3 3 44.018 88.035 0.451 2.88 4 44.6 6.3
464 5 1 -5 44.045 88.091 0.451 2.88 4 72.3 16.6
465 0 1 5 44.055 88.109 0.451 2.88 4 119.8 45.7
466 5 8 -3 44.119 88.238 0.452 2.88 4 17.7 1.0
467 3 12 0 44.122 88.244 0.452 2.88 4 70.7 15.9
468 2 8 3 44.127 88.254 0.452 2.88 4 64.4 13.2
469 5 6 0 44.173 88.345 0.452 2.87 4 63.6 12.9
470 5 2 -5 44.452 88.904 0.455 2.86 4 14.1 0.6
471 0 2 5 44.461 88.922 0.455 2.86 4 46.6 6.9
472 5 8 -1 44.479 88.957 0.455 2.86 4 23.1 1.7
473 4 8 1 44.482 88.964 0.455 2.86 4 35.7 4.0
474 4 11 -2 44.496 88.992 0.455 2.85 4 97.3 29.9
475 2 11 2 44.5 89.001 0.455 2.85 4 36.9 4.3
476 4 10 0 44.585 89.169 0.456 2.85 4 157.6 78.3
477 3 10 -4 44.787 89.573 0.457 2.84 4 73.7 17.1
478 1 10 -4 44.79 89.579 0.457 2.84 4 79.4 19.8
479 4 11 -1 44.86 89.721 0.458 2.84 4 7.3 0.2
480 3 11 1 44.863 89.726 0.458 2.84 4 59.7 11.2
481 6 4 -2 44.952 89.903 0.459 2.83 4 2.9 0.0
482 6 4 -3 44.956 89.913 0.459 2.83 4 177.6 98.6
483 4 4 2 44.959 89.918 0.459 2.83 4 12.1 0.5
484 4 9 -4 44.964 89.928 0.459 2.83 4 216.0 146.0
485 3 4 3 44.966 89.933 0.459 2.83 4 213.3 142.3
486 0 9 4 44.97 89.94 0.459 2.83 4 33.2 3.5
487 6 0 -4 44.999 89.998 0.459 2.83 2 111.6 19.5
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 5.581 11.163 7.92 613.7 11.6 11.8 5.6
2 1 0 0 7.271 14.542 6.08633 390.6 7.4 7.5 5.6
3 1 1 0 7.792 15.584 5.68137 504.6 9.6 9.7 5.6
4 1 1 -1 8.452 16.904 5.24062 275.7 5.2 5.3 5.6
5 1 2 0 9.184 18.369 4.82593 93.3 1.8 1.8 5.6
6 0 2 1 9.754 19.509 4.54646 118.4 2.2 2.3 5.6
7 1 3 0 11.136 22.271 3.98836 103.2 2.0 2.0 5.6
8 1 3 -1 11.613 23.226 3.82652 379.9 7.2 7.2 5.6
9 1 1 1 13.393 26.786 3.32552 1826.5 34.6 34.7 5.6
10 1 4 -1 13.822 27.644 3.22422 5226.3 99.1 99.2 5.6
11 1 0 -2 14.293 28.586 3.12 5272.6 100.0 100.0 5.6
12 2 0 0 14.662 29.324 3.04317 1014.3 19.2 19.2 5.6
13 2 1 0 14.936 29.873 2.98851 445.0 8.4 8.4 5.6
14 1 2 -2 15.388 30.776 2.90287 1118.0 21.2 21.2 5.6
15 2 3 -1 15.626 31.251 2.85976 1539.9 29.2 29.1 5.6
16 2 2 0 15.733 31.467 2.84069 4048.5 76.8 76.6 5.6
17 1 5 0 15.909 31.818 2.81012 1311.8 24.9 24.8 5.6
18 2 0 -2 16.106 32.211 2.77668 1005.6 19.1 19.0 5.6
19 0 5 1 16.256 32.513 2.75162 716.7 13.6 13.5 5.6
20 2 1 -2 16.358 32.716 2.73498 442.1 8.4 8.4 5.6
21 1 3 -2 16.664 33.329 2.68609 960.0 18.2 18.1 5.7
22 2 3 0 16.987 33.973 2.63659 2353.7 44.6 44.4 5.7
23 0 2 2 17.098 34.196 2.61992 3097.6 58.7 58.5 5.7
24 2 3 -2 18.266 36.532 2.45757 341.2 6.5 6.4 5.7
25 1 4 -2 18.319 36.638 2.45073 1065.4 20.2 20.1 5.7
26 1 6 0 18.544 37.089 2.42197 2587.8 49.1 48.7 5.7
27 1 6 -1 18.848 37.697 2.38429 159.5 3.0 3.0 5.7
28 2 5 -1 19.405 38.81 2.31842 691.6 13.1 13.0 5.7
29 2 4 -2 19.804 39.609 2.27348 1708.0 32.4 32.1 5.7
30 2 5 0 20.547 41.095 2.19465 56.6 1.1 1.1 5.7
31 1 0 2 20.709 41.418 2.17828 113.4 2.2 2.1 5.7
32 3 1 -2 20.908 41.817 2.1584 1348.5 25.6 25.3 5.7
33 1 7 0 21.295 42.59 2.12101 552.1 10.5 10.3 5.7
34 1 2 2 21.515 43.031 2.10029 95.2 1.8 1.8 5.7
35 0 7 1 21.567 43.133 2.09552 95.6 1.8 1.8 5.7
36 0 5 2 21.649 43.298 2.08794 758.0 14.4 14.2 5.7
37 3 3 -1 21.692 43.383 2.08403 146.5 2.8 2.7 5.7
38 2 1 -3 22.26 44.521 2.03339 101.2 1.9 1.9 5.7
39 3 0 0 22.314 44.627 2.02878 103.4 2.0 1.9 5.7
40 1 3 2 22.49 44.981 2.01365 570.2 10.8 10.6 5.7
41 2 2 -3 22.834 45.669 1.98492 55.5 1.1 1.0 5.7
42 0 8 0 22.894 45.788 1.98 171.4 3.3 3.2 5.7
43 3 4 -1 23.039 46.079 1.9682 203.0 3.8 3.8 5.7
44 3 2 0 23.075 46.15 1.96532 56.4 1.1 1.1 5.7
45 1 3 -3 23.768 47.536 1.91119 407.0 7.7 7.6 5.7
46 1 4 2 23.803 47.605 1.90859 884.2 16.8 16.5 5.7
47 3 3 0 24.0 48.0 1.89379 1272.7 24.1 23.7 5.7
48 1 8 0 24.148 48.296 1.88287 1688.0 32.0 31.4 5.7
49 1 8 -1 24.395 48.789 1.865 98.5 1.9 1.8 5.7
50 2 5 1 24.69 49.38 1.84406 111.7 2.1 2.1 5.7
51 0 1 3 24.772 49.545 1.83831 761.2 14.4 14.1 5.7
52 1 7 -2 24.867 49.733 1.83179 189.0 3.6 3.5 5.7
53 1 4 -3 25.029 50.058 1.82067 1724.7 32.7 32.0 5.7
54 3 4 0 25.252 50.504 1.80561 235.0 4.5 4.4 5.8
55 3 2 -3 25.298 50.596 1.80254 953.4 18.1 17.7 5.8
56 3 5 -2 25.41 50.819 1.79517 902.2 17.1 16.7 5.8
57 2 7 -2 26.048 52.096 1.75413 732.2 13.9 13.6 5.8
58 3 3 -3 26.164 52.329 1.74687 184.4 3.5 3.4 5.8
59 2 6 1 26.6 53.201 1.72028 822.9 15.6 15.2 5.8
60 1 8 1 26.753 53.506 1.71118 261.5 5.0 4.8 5.8
61 2 0 2 26.932 53.864 1.70066 284.7 5.4 5.3 5.8
62 4 1 -2 27.094 54.188 1.69126 222.8 4.2 4.1 5.8
63 1 6 2 27.287 54.574 1.68018 700.9 13.3 12.9 5.8
64 0 4 3 27.348 54.696 1.67672 261.5 5.0 4.8 5.8
65 1 8 -2 27.436 54.872 1.67177 849.5 16.1 15.7 5.8
66 4 1 -1 27.54 55.081 1.66592 747.0 14.2 13.8 5.8
67 2 2 2 27.597 55.194 1.66276 873.9 16.6 16.1 5.8
68 2 8 0 27.654 55.307 1.65963 140.1 2.7 2.6 5.8
69 4 2 -1 28.033 56.067 1.63895 405.5 7.7 7.5 5.8
70 2 3 2 28.414 56.829 1.61877 563.9 10.7 10.4 5.8
71 2 8 -2 28.542 57.085 1.61211 211.9 4.0 3.9 5.8
72 3 6 0 28.61 57.219 1.60864 334.9 6.4 6.2 5.8
73 3 5 -3 28.813 57.625 1.59827 133.4 2.5 2.5 5.8
74 4 3 -1 28.842 57.684 1.59677 125.9 2.4 2.3 5.8
75 0 10 0 29.097 58.194 1.584 53.4 1.0 1.0 5.8
76 2 4 2 29.533 59.067 1.56265 66.1 1.3 1.2 5.8
77 2 0 -4 29.589 59.177 1.56 372.5 7.1 6.8 5.8
78 2 1 -4 29.746 59.492 1.55249 226.8 4.3 4.2 5.8
79 1 2 3 29.785 59.57 1.55065 68.4 1.3 1.3 5.8
80 2 9 0 30.37 60.74 1.52355 194.3 3.7 3.6 5.8
81 4 0 0 30.413 60.827 1.52158 83.2 1.6 1.5 5.8
82 4 3 -3 30.558 61.116 1.51507 166.8 3.2 3.0 5.8
83 3 1 -4 30.798 61.597 1.50439 185.4 3.5 3.4 5.8
84 4 5 -2 30.93 61.86 1.49862 297.9 5.7 5.4 5.8
85 4 2 0 31.03 62.061 1.49426 114.3 2.2 2.1 5.8
86 2 8 1 31.093 62.187 1.49153 449.3 8.5 8.2 5.8
87 1 8 2 31.717 63.435 1.46517 111.3 2.1 2.0 5.9
88 3 3 -4 32.017 64.034 1.45289 121.7 2.3 2.2 5.9
89 2 10 -1 32.44 64.88 1.43597 170.0 3.2 3.1 5.9
90 3 7 -3 32.521 65.042 1.43278 290.0 5.5 5.3 5.9
91 4 4 0 32.842 65.683 1.42034 90.7 1.7 1.6 5.9
92 3 8 0 32.929 65.858 1.417 56.1 1.1 1.0 5.9
93 3 6 1 32.998 65.996 1.41437 161.5 3.1 2.9 5.9
94 1 10 -2 33.05 66.1 1.4124 124.0 2.4 2.2 5.9
95 2 10 0 33.245 66.49 1.40506 59.7 1.1 1.1 5.9
96 2 5 -4 33.394 66.787 1.39952 95.2 1.8 1.7 5.9
97 1 11 -1 33.546 67.092 1.3939 538.6 10.2 9.8 5.9
98 4 0 -4 33.698 67.397 1.38834 68.0 1.3 1.2 5.9
99 0 1 4 33.851 67.703 1.38281 260.9 4.9 4.7 5.9
100 2 10 -2 34.045 68.091 1.37587 202.4 3.8 3.7 5.9
101 4 5 0 34.166 68.333 1.37158 294.9 5.6 5.3 5.9
102 1 9 2 34.24 68.481 1.36899 70.8 1.3 1.3 5.9
103 0 2 4 34.289 68.578 1.36727 241.9 4.6 4.4 5.9
104 5 1 -2 34.422 68.843 1.36265 249.9 4.7 4.5 5.9
105 4 7 -2 34.508 69.015 1.35968 284.1 5.4 5.1 5.9
106 1 6 3 34.599 69.198 1.35654 538.2 10.2 9.7 5.9
107 3 2 2 34.862 69.725 1.34757 53.5 1.0 1.0 5.9
108 4 7 -1 34.897 69.794 1.34641 86.4 1.6 1.6 5.9
109 4 3 -4 35.007 70.014 1.3427 386.6 7.3 7.0 5.9
110 1 9 -3 35.226 70.452 1.33543 307.1 5.8 5.5 5.9
111 2 1 3 35.413 70.826 1.32929 365.2 6.9 6.6 5.9
112 5 3 -2 35.575 71.151 1.32402 155.5 3.0 2.8 5.9
113 5 2 -3 35.834 71.669 1.31572 279.7 5.3 5.0 5.9
114 1 6 -4 35.969 71.939 1.31145 310.8 5.9 5.6 5.9
115 1 12 0 36.663 73.327 1.29001 78.7 1.5 1.4 6.0
116 0 12 1 36.856 73.712 1.28421 204.3 3.9 3.7 6.0
117 1 10 2 36.961 73.921 1.28109 525.0 10.0 9.4 6.0
118 0 11 2 37.056 74.112 1.27828 175.3 3.3 3.1 6.0
119 1 7 -4 37.804 75.608 1.25665 275.8 5.2 4.9 6.0
120 3 5 2 37.844 75.688 1.25553 57.3 1.1 1.0 6.0
121 5 4 -1 37.903 75.806 1.25387 259.2 4.9 4.6 6.0
122 3 10 0 38.094 76.188 1.24852 300.3 5.7 5.3 6.0
123 3 1 -5 38.487 76.974 1.23772 77.7 1.5 1.4 6.0
124 4 8 -3 38.56 77.12 1.23574 230.1 4.4 4.1 6.0
125 5 1 -4 38.66 77.32 1.23304 111.6 2.1 2.0 6.0
126 2 12 -1 38.751 77.501 1.23061 184.8 3.5 3.3 6.0
127 5 2 -4 39.076 78.152 1.22198 63.5 1.2 1.1 6.0
128 4 5 1 39.157 78.315 1.21985 265.0 5.0 4.7 6.0
129 5 0 0 39.257 78.513 1.21727 97.5 1.8 1.7 6.0
130 3 11 -1 39.317 78.634 1.2157 138.7 2.6 2.5 6.0
131 3 6 2 39.372 78.745 1.21427 327.6 6.2 5.8 6.0
132 3 9 1 39.408 78.816 1.21335 84.1 1.6 1.5 6.0
133 2 12 0 39.5 79.0 1.21099 159.7 3.0 2.8 6.0
134 0 10 3 39.797 79.594 1.20344 504.8 9.6 8.9 6.0
135 1 8 -4 39.885 79.769 1.20123 196.9 3.7 3.5 6.0
136 1 13 0 40.145 80.289 1.19475 97.1 1.8 1.7 6.0
137 4 1 -5 40.356 80.713 1.18955 155.0 2.9 2.7 6.1
138 5 3 0 40.496 80.992 1.18615 69.8 1.3 1.2 6.1
139 3 4 -5 40.558 81.115 1.18466 395.7 7.5 7.0 6.1
140 4 7 -4 40.611 81.222 1.18337 123.0 2.3 2.2 6.1
141 1 4 4 40.737 81.474 1.18034 82.2 1.6 1.4 6.1
142 1 2 -5 40.773 81.546 1.17948 316.8 6.0 5.6 6.1
143 1 11 -3 40.819 81.639 1.17838 132.1 2.5 2.3 6.1
144 5 7 -2 41.152 82.305 1.17052 146.3 2.8 2.6 6.1
145 5 4 0 41.454 82.908 1.16354 61.2 1.2 1.1 6.1
146 4 10 -2 41.643 83.286 1.15921 126.4 2.4 2.2 6.1
147 3 5 -5 41.788 83.576 1.15592 99.1 1.9 1.7 6.1
148 1 5 4 41.967 83.933 1.15191 138.7 2.6 2.4 6.1
149 4 9 0 42.005 84.01 1.15106 197.7 3.8 3.5 6.1
150 2 7 3 42.09 84.179 1.14917 111.9 2.1 2.0 6.1
151 3 9 -4 42.208 84.416 1.14655 91.6 1.7 1.6 6.1
152 4 4 -5 42.405 84.811 1.14222 89.4 1.7 1.6 6.1
153 5 5 0 42.68 85.359 1.13627 126.5 2.4 2.2 6.1
154 4 0 2 42.789 85.578 1.13394 324.6 6.2 5.7 6.1
155 0 14 0 42.906 85.813 1.13143 85.5 1.6 1.5 6.1
156 3 8 2 43.201 86.402 1.12522 213.5 4.0 3.7 6.1
157 6 2 -2 43.325 86.649 1.12264 67.1 1.3 1.2 6.1
158 1 6 4 43.462 86.924 1.1198 92.6 1.8 1.6 6.1
159 4 5 -5 43.628 87.256 1.11639 109.1 2.1 1.9 6.2
160 2 13 -2 43.659 87.318 1.11576 164.5 3.1 2.9 6.2
161 2 12 -3 43.949 87.898 1.10988 182.5 3.5 3.2 6.2
162 3 3 3 44.018 88.035 1.10851 57.1 1.1 1.0 6.2
163 0 1 5 44.055 88.109 1.10777 62.3 1.2 1.1 6.2
164 4 10 0 44.585 89.169 1.09732 78.3 1.5 1.4 6.2
165 3 4 3 44.966 89.933 1.08998 390.8 7.4 6.7 6.2
Reference:
Chichagov A.V. et al.
Information-Calculating System on Crystal Structure Data of Minerals
(MINCRYST)
- Kristallographiya, v.35, n.3, 1990, p.610-616 (in Russian)
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