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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PERETAITE
1
CaSb(4)O(4)(OH)(2)[SO(4)](2).2H(2)O
Monoclinic C 2/c Z = 4
R =0.037 NR =2044
24 .10 .1990
Ref.Str.:
Menchetti S., Sabelli C. (1980)
* Amer. Mineral., 65, 940-946
Reserv:
See U(ij) in the original
Initial data from BDM-file
Lattice parameters (cub. angs.,degr.):
a = 24.665 alpha = 90.0
b = 5.6006 beta = 95.98
c = 10.185 gamma = 90.0
Unit cell volume (cub. angs.) = 1399.29
Molar volume ( cub.cm/mol.) = 210.71
Co-ordinates, thermal parameters, occupation for atomic positions:
NoP x/a y/b z/c B(j) atom / occupation
1 0.2925 0.505 0.5153 0.79 Sb = 1.00
2 0.3154 0.052 0.262 0.65 Sb = 1.00
3 0.5 0.1856 0.25 0.92 Ca = 1.00
4 0.4201 0.9837 0.5184 0.94 S = 1.00
5 0.36 0.0049 0.5276 2.0 O = 1.00
6 0.4296 0.0463 0.3829 1.55 O = 1.00
7 0.4511 0.1391 0.6154 1.7 O = 1.00
8 0.4378 0.7365 0.5487 1.52 O = 1.00
9 0.4446 0.5206 0.3043 1.3 O = 1.00
10 0.2609 0.1778 0.3871 0.59 O = 1.00
11 0.2625 0.1787 0.1146 0.56 O = 1.00
12 0.3394 0.386 0.2667 1.05 O = 1.00
13 0.45 0.6 0.21 4.0 H = 1.00
14 0.45 0.66 0.38 4.0 H = 1.00
15 0.382 0.42 0.285 4.0 H = 1.00
Co-ordinates for all atomic positions :
No NoP x/a y/b z/c
1 1 0.2925 0.505 0.5153
2 2 0.3154 0.052 0.262
3 3 0.5 0.1856 0.25
4 4 0.4201 0.9837 0.5184
5 5 0.36 0.0049 0.5276
6 6 0.4296 0.0463 0.3829
7 7 0.4511 0.1391 0.6154
8 8 0.4378 0.7365 0.5487
9 9 0.4446 0.5206 0.3043
10 10 0.2609 0.1778 0.3871
11 11 0.2625 0.1787 0.1146
12 12 0.3394 0.386 0.2667
13 13 0.45 0.6 0.21
14 14 0.45 0.66 0.38
15 15 0.382 0.42 0.285
16 1 0.7075 0.495 0.4847
17 2 0.6846 0.948 0.738
18 3 0.5 0.8144 0.75
19 4 0.5799 0.0163 0.4816
20 5 0.64 0.9951 0.4724
21 6 0.5704 0.9537 0.6171
22 7 0.5489 0.8609 0.3846
23 8 0.5622 0.2635 0.4513
24 9 0.5554 0.4794 0.6957
25 10 0.7391 0.8222 0.6129
26 11 0.7375 0.8213 0.8854
27 12 0.6606 0.614 0.7333
28 13 0.55 0.4 0.79
29 14 0.55 0.34 0.62
30 15 0.618 0.58 0.715
31 1 0.2925 0.495 0.0152
32 2 0.3154 0.948 0.762
33 4 0.4201 0.0163 0.0184
34 5 0.36 0.9951 0.0276
35 6 0.4296 0.9537 0.8829
36 7 0.4511 0.8609 0.1154
37 8 0.4378 0.2635 0.0487
38 9 0.4446 0.4794 0.8043
39 10 0.2609 0.8222 0.8871
40 11 0.2625 0.8213 0.6146
41 12 0.3394 0.614 0.7667
42 13 0.45 0.4 0.71
43 14 0.45 0.34 0.88
44 15 0.382 0.58 0.785
45 1 0.7075 0.505 0.9847
46 2 0.6846 0.052 0.238
47 4 0.5799 0.9837 0.9816
48 5 0.64 0.0049 0.9724
49 6 0.5704 0.0463 0.1171
50 7 0.5489 0.1391 0.8846
51 8 0.5622 0.7365 0.9513
52 9 0.5554 0.5206 0.1957
53 10 0.7391 0.1778 0.1129
54 11 0.7375 0.1787 0.3854
55 12 0.6606 0.386 0.2333
56 13 0.55 0.6 0.29
57 14 0.55 0.66 0.12
58 15 0.618 0.42 0.215
59 1 0.7925 0.995 0.0152
60 2 0.8154 0.448 0.762
61 3 0.0 0.3144 0.75
62 4 0.9201 0.5163 0.0184
63 5 0.86 0.4951 0.0276
64 6 0.9296 0.4537 0.8829
65 7 0.9511 0.3609 0.1154
66 8 0.9378 0.7635 0.0487
67 9 0.9446 0.9794 0.8043
68 10 0.7609 0.3222 0.8871
69 11 0.7625 0.3213 0.6146
70 12 0.8394 0.114 0.7667
71 13 0.95 0.9 0.71
72 14 0.95 0.84 0.88
73 15 0.882 0.08 0.785
74 1 0.2075 0.005 0.9847
75 2 0.1846 0.552 0.238
76 3 0.0 0.6856 0.25
77 4 0.0799 0.4837 0.9816
78 5 0.14 0.5049 0.9724
79 6 0.0704 0.5463 0.1171
80 7 0.0489 0.6391 0.8846
81 8 0.0622 0.2365 0.9513
82 9 0.0554 0.0206 0.1957
83 10 0.2391 0.6778 0.1129
84 11 0.2375 0.6787 0.3854
85 12 0.1606 0.886 0.2333
86 13 0.05 0.1 0.29
87 14 0.05 0.16 0.12
88 15 0.118 0.92 0.215
89 1 0.7925 0.005 0.5152
90 2 0.8154 0.552 0.262
91 4 0.9201 0.4837 0.5184
92 5 0.86 0.5049 0.5276
93 6 0.9296 0.5463 0.3829
94 7 0.9511 0.6391 0.6154
95 8 0.9378 0.2365 0.5487
96 9 0.9446 0.0206 0.3043
97 10 0.7609 0.6778 0.3871
98 11 0.7625 0.6787 0.1146
99 12 0.8394 0.886 0.2667
100 13 0.95 0.1 0.21
101 14 0.95 0.16 0.38
102 15 0.882 0.92 0.285
103 1 0.2075 0.995 0.4848
104 2 0.1846 0.448 0.738
105 4 0.0799 0.5163 0.4816
106 5 0.14 0.4951 0.4724
107 6 0.0704 0.4537 0.6171
108 7 0.0489 0.3609 0.3846
109 8 0.0622 0.7635 0.4513
110 9 0.0554 0.9794 0.6957
111 10 0.2391 0.3222 0.6129
112 11 0.2375 0.3213 0.8854
113 12 0.1606 0.114 0.7333
114 13 0.05 0.9 0.79
115 14 0.05 0.84 0.62
116 15 0.118 0.08 0.715
X-ray density (g/cm cub.) = 4.05
MU (1/cm) = 695.858 Mass attenuation coefficient (cm**2/g) = 171.867
Selected interatomic distances (cation-anion,anion-anion):
NoP Atom Rad.sph. C.N. Distance NoP N.
(angs.) (angs.)
1 Sb 2.712 4
2.3362 10
2.2055 11
2.0398 11
2.0112 10
2 Sb 2.712 3
2.0695 10
2.0122 11
1.9615 12
3 Ca 2.88 8
2.4384 6
2.4188 9
2.5093 7
2.4682 8
2.5093 7
2.4682 8
2.4384 6
2.4188 9
4 S 1.98 4
1.4997 5
1.4662 6
1.47 7
1.4746 8
5 O 3.264 5
2.3874 6
2.4484 7
2.4294 8
2.869 10
2.8407 11
6 O 3.264 8
2.3874 5
2.4284 7
2.4149 8
2.8099 9
3.0835 9
3.0694 12
3.1187 7
3.0138 7
7 O 3.264 7
2.4484 5
2.4284 6
2.3679 8
3.1187 6
3.2374 9
3.0138 6
2.7247 9
8 O 3.264 5
2.4294 5
2.4149 6
2.3679 7
2.7881 9
2.9644 9
9 O 3.264 8
3.0835 6
2.8099 6
2.7881 8
2.6908 12
3.2374 7
2.7247 7
2.9644 8
3.0532 9
10 O 3.264 8
2.869 5
2.7798 11
2.6659 12
3.0558 11
2.8638 11
2.8539 11
3.2307 12
2.5475 10
11 O 3.264 7
2.7798 10
2.5948 12
2.8407 5
3.0558 10
2.8539 10
2.8638 10
2.4835 11
12 O 3.264 5
3.0694 6
2.6908 9
2.6659 10
2.5948 11
3.2307 10
13 H 1.632 1
1.0792 9
14 H 1.632 1
1.0956 9
15 H 1.632 1
1.065 12
X-ray diffraction powder data (II), X-Ray W.L. = 1.54056(angs.):
No H K L Theta 2*Theta S LPG MF F I int.
( degree ) *100
1 2 0 0 3.601 7.201 0.041 504.11 2 435.3 9757.7
2 4 0 0 7.216 14.431 0.082 123.82 2 218.1 601.7
3 1 1 0 8.11 16.22 0.092 97.55 4 205.2 839.2
4 0 0 2 8.748 17.496 0.099 83.53 2 56.2 26.9
5 2 0 -2 9.113 18.226 0.103 76.8 2 82.3 53.2
6 1 1 -1 9.132 18.263 0.103 76.48 4 135.3 285.8
7 1 1 1 9.312 18.624 0.105 73.46 4 113.6 193.7
8 3 1 0 9.596 19.192 0.108 69.05 4 45.2 28.9
9 2 0 2 9.816 19.632 0.111 65.89 2 60.5 24.6
10 3 1 -1 10.318 20.636 0.116 59.43 4 95.0 109.5
11 4 0 -2 10.771 21.542 0.121 54.36 2 75.5 31.6
12 3 1 1 10.793 21.585 0.122 54.13 4 135.7 203.5
13 6 0 0 10.86 21.719 0.122 53.44 2 101.1 55.8
14 1 1 -2 11.831 23.662 0.133 44.69 4 21.4 4.2
15 4 0 2 11.952 23.904 0.134 43.76 2 90.7 36.8
16 5 1 0 12.048 24.095 0.135 43.03 4 131.8 152.6
17 1 1 2 12.112 24.224 0.136 42.55 4 135.5 159.6
18 5 1 -1 12.502 25.004 0.141 39.81 4 207.6 350.4
19 3 1 -2 12.647 25.294 0.142 38.86 4 374.2 1111.8
20 5 1 1 13.16 26.32 0.148 35.73 4 147.6 159.0
21 6 0 -2 13.266 26.531 0.149 35.13 2 511.3 938.0
22 3 1 2 13.425 26.85 0.151 34.25 4 570.8 2280.0
23 5 1 -2 14.385 28.77 0.161 29.58 4 734.1 3256.1
24 8 0 0 14.549 29.098 0.163 28.87 2 588.8 1022.5
25 6 0 2 14.724 29.447 0.165 28.14 2 409.0 480.9
26 7 1 0 15.028 30.056 0.168 26.94 4 149.4 122.8
27 7 1 -1 15.289 30.578 0.171 25.96 4 7.9 0.3
28 1 1 -3 15.392 30.785 0.172 25.59 4 26.0 3.5
29 5 1 2 15.528 31.057 0.174 25.11 4 681.0 2378.6
30 1 1 3 15.723 31.447 0.176 24.44 4 147.6 108.7
31 3 1 -3 15.933 31.865 0.178 23.76 4 97.0 45.6
32 0 2 0 15.966 31.932 0.179 23.65 2 664.1 1065.3
33 7 1 1 16.056 32.112 0.18 23.36 4 28.8 4.0
34 8 0 -2 16.247 32.493 0.182 22.77 2 113.3 29.9
35 2 2 0 16.388 32.777 0.183 22.35 4 382.6 668.3
36 0 2 1 16.582 33.164 0.185 21.79 4 241.2 259.0
37 7 1 -2 16.785 33.57 0.187 21.22 4 337.6 494.2
38 3 1 3 16.88 33.759 0.188 20.96 4 15.4 1.0
39 2 2 -1 16.888 33.777 0.189 20.94 4 161.9 112.1
40 2 2 1 17.092 34.185 0.191 20.4 4 73.6 22.5
41 5 1 -3 17.271 34.542 0.193 19.94 4 113.0 52.0
42 4 2 0 17.601 35.202 0.196 19.13 4 43.0 7.2
43 2 0 -4 17.705 35.409 0.197 18.89 2 606.0 708.6
44 0 0 4 17.708 35.417 0.197 18.88 2 662.6 846.8
45 8 0 2 17.873 35.746 0.199 18.5 2 27.2 1.4
46 4 2 -1 17.975 35.949 0.2 18.27 4 76.7 22.0
47 7 1 2 18.178 36.356 0.203 17.83 4 274.0 273.4
48 10 0 0 18.301 36.602 0.204 17.57 2 279.3 140.0
49 9 1 0 18.318 36.637 0.204 17.53 4 316.5 358.6
50 0 2 2 18.319 36.639 0.204 17.53 4 140.5 70.7
51 4 2 1 18.36 36.719 0.204 17.44 4 102.6 37.5
52 9 1 -1 18.443 36.886 0.205 17.27 4 12.3 0.5
53 4 0 -4 18.467 36.934 0.206 17.22 2 105.7 19.7
54 2 0 4 18.477 36.955 0.206 17.2 2 83.9 12.4
55 2 2 -2 18.506 37.012 0.206 17.14 4 24.8 2.2
56 5 1 3 18.726 37.452 0.208 16.7 4 170.7 99.4
57 2 2 2 18.882 37.764 0.21 16.4 4 88.8 26.4
58 7 1 -3 19.262 38.524 0.214 15.69 4 60.0 11.5
59 9 1 1 19.282 38.564 0.214 15.66 4 45.7 6.7
60 1 1 -4 19.409 38.818 0.216 15.43 4 80.0 20.2
61 4 2 -2 19.424 38.847 0.216 15.4 4 207.8 135.9
62 6 2 0 19.476 38.951 0.216 15.31 4 134.8 56.8
63 10 0 -2 19.532 39.064 0.217 15.22 2 35.2 1.9
64 9 1 -2 19.639 39.278 0.218 15.03 4 263.1 212.6
65 6 2 -1 19.729 39.458 0.219 14.88 4 25.3 1.9
66 3 1 -4 19.764 39.527 0.219 14.82 4 111.0 37.3
67 1 1 4 19.77 39.54 0.22 14.81 4 35.7 3.8
68 6 0 -4 19.919 39.839 0.221 14.57 2 160.2 38.2
69 4 0 4 19.936 39.871 0.221 14.54 2 99.7 14.7
70 4 2 2 20.14 40.279 0.223 14.21 4 39.1 4.4
71 6 2 1 20.261 40.523 0.225 14.02 4 161.4 74.6
72 5 1 -4 20.803 41.606 0.231 13.22 4 20.5 1.1
73 3 1 4 20.815 41.631 0.231 13.2 4 9.8 0.3
74 0 2 3 20.938 41.876 0.232 13.03 4 149.5 59.5
75 6 2 -2 20.991 41.981 0.233 12.96 4 132.0 46.1
76 2 2 -3 21.02 42.041 0.233 12.92 4 44.8 5.3
77 7 1 3 21.11 42.221 0.234 12.8 4 146.5 56.1
78 9 1 2 21.208 42.416 0.235 12.66 4 31.7 2.6
79 10 0 2 21.277 42.554 0.236 12.57 2 147.8 28.1
80 2 2 3 21.526 43.052 0.238 12.25 4 40.0 4.0
81 9 1 -3 21.756 43.513 0.241 11.96 4 9.4 0.2
82 4 2 -3 21.767 43.533 0.241 11.95 4 16.6 0.7
83 11 1 0 21.826 43.651 0.241 11.87 4 366.8 326.4
84 11 1 -1 21.851 43.702 0.242 11.84 4 117.3 33.3
85 8 2 0 21.871 43.742 0.242 11.82 4 507.8 622.5
86 8 0 -4 21.948 43.896 0.243 11.72 2 366.2 160.6
87 6 0 4 21.969 43.938 0.243 11.7 2 553.8 366.5
88 6 2 2 21.994 43.988 0.243 11.67 4 187.0 83.4
89 8 2 -1 22.02 44.04 0.243 11.64 4 116.3 32.2
90 12 0 0 22.136 44.272 0.245 11.5 2 70.7 5.9
91 7 1 -4 22.449 44.898 0.248 11.14 4 209.0 99.4
92 5 1 4 22.467 44.933 0.248 11.12 4 156.8 55.9
93 8 2 1 22.668 45.337 0.25 10.9 4 94.5 19.9
94 4 2 3 22.743 45.485 0.251 10.82 4 50.0 5.5
95 11 1 1 22.744 45.489 0.251 10.82 4 141.8 44.5
96 11 1 -2 22.819 45.638 0.252 10.74 4 166.3 60.6
97 12 0 -2 23.04 46.08 0.254 10.51 2 299.4 96.2
98 8 2 -2 23.101 46.201 0.255 10.45 4 185.5 73.4
99 6 2 -3 23.125 46.25 0.255 10.42 4 146.3 45.5
100 1 1 -5 23.732 47.464 0.261 9.83 4 112.8 25.5
101 9 1 3 23.909 47.818 0.263 9.66 4 79.0 12.3
102 3 1 -5 23.958 47.916 0.264 9.62 4 5.8 0.1
103 1 1 5 24.117 48.233 0.265 9.47 4 148.9 42.9
104 2 2 -4 24.208 48.417 0.266 9.39 4 575.6 635.8
105 0 2 4 24.211 48.422 0.266 9.39 4 553.0 586.6
106 8 2 2 24.339 48.678 0.268 9.28 4 72.2 9.9
107 10 0 -4 24.443 48.886 0.269 9.19 2 558.7 293.0
108 1 3 0 24.444 48.887 0.269 9.19 4 4.9 0.0
109 8 0 4 24.468 48.935 0.269 9.17 2 461.7 199.6
110 6 2 3 24.514 49.028 0.269 9.13 4 220.8 90.9
111 11 1 2 24.525 49.05 0.269 9.12 4 285.0 151.3
112 9 1 -4 24.608 49.215 0.27 9.05 4 254.0 119.3
113 7 1 4 24.63 49.259 0.271 9.03 4 214.8 85.1
114 11 1 -3 24.642 49.284 0.271 9.02 4 182.9 61.6
115 10 2 0 24.674 49.347 0.271 9.0 4 356.9 234.1
116 10 2 -1 24.735 49.469 0.272 8.94 4 139.1 35.4
117 5 1 -5 24.781 49.562 0.272 8.91 4 170.1 52.6
118 4 2 -4 24.804 49.609 0.272 8.89 4 212.4 81.9
119 2 2 4 24.813 49.625 0.272 8.88 4 280.8 143.0
120 1 3 -1 24.843 49.686 0.273 8.86 4 70.1 8.9
121 12 0 2 24.884 49.767 0.273 8.82 2 371.7 124.5
122 1 3 1 24.918 49.836 0.273 8.8 4 84.0 12.7
123 8 2 -3 25.02 50.039 0.275 8.71 4 184.1 60.3
124 3 3 0 25.038 50.076 0.275 8.7 4 41.5 3.1
125 3 1 5 25.09 50.181 0.275 8.66 4 67.2 8.0
126 3 3 -1 25.357 50.714 0.278 8.45 4 315.5 171.9
127 13 1 -1 25.465 50.93 0.279 8.37 4 16.6 0.5
128 10 2 1 25.476 50.953 0.279 8.36 4 132.4 30.0
129 13 1 0 25.515 51.031 0.28 8.33 4 1.9 0.0
130 3 3 1 25.578 51.155 0.28 8.29 4 229.7 89.3
131 10 2 -2 25.655 51.309 0.281 8.23 4 110.9 20.7
132 6 2 -4 25.969 51.937 0.284 8.01 4 49.2 4.0
133 4 2 4 25.982 51.964 0.284 8.0 4 69.7 7.9
134 14 0 0 26.079 52.158 0.285 7.93 2 123.7 12.4
135 1 3 -2 26.087 52.174 0.285 7.92 4 71.8 8.3
136 7 1 -5 26.16 52.321 0.286 7.87 4 12.4 0.2
137 5 3 0 26.198 52.395 0.287 7.85 4 261.1 109.3
138 1 3 2 26.231 52.462 0.287 7.83 4 62.3 6.2
139 13 1 -2 26.259 52.518 0.287 7.81 4 364.7 212.0
140 13 1 1 26.407 52.814 0.289 7.71 4 66.2 6.9
141 5 3 -1 26.435 52.87 0.289 7.69 4 166.9 43.8
142 3 3 -2 26.512 53.024 0.29 7.64 4 341.0 181.4
143 5 1 5 26.606 53.211 0.291 7.58 4 42.3 2.8
144 14 0 -2 26.74 53.481 0.292 7.49 2 507.9 197.3
145 8 2 3 26.762 53.523 0.292 7.48 4 159.7 39.0
146 5 3 1 26.791 53.582 0.293 7.46 4 196.8 59.0
147 3 3 2 26.938 53.876 0.294 7.37 4 420.8 266.4
148 2 0 -6 27.003 54.005 0.295 7.33 2 60.2 2.7
149 11 1 3 27.041 54.081 0.295 7.3 4 129.3 24.9
150 10 2 2 27.087 54.175 0.296 7.27 4 265.9 105.1
151 0 0 6 27.146 54.292 0.296 7.24 2 61.0 2.7
152 11 1 -4 27.194 54.388 0.297 7.21 4 439.2 284.1
153 9 1 4 27.219 54.439 0.297 7.19 4 244.7 88.0
154 12 0 -4 27.318 54.637 0.298 7.13 2 108.0 8.5
155 10 0 4 27.346 54.693 0.298 7.12 2 388.2 109.6
156 10 2 -3 27.372 54.743 0.298 7.1 4 206.3 61.7
157 4 0 -6 27.415 54.831 0.299 7.08 2 9.3 0.1
158 5 3 -2 27.489 54.977 0.3 7.03 4 395.5 224.8
159 8 2 -4 27.65 55.301 0.301 6.94 4 257.9 94.3
160 6 2 4 27.668 55.336 0.301 6.93 4 204.2 59.0
161 12 2 -1 27.796 55.592 0.303 6.86 4 91.0 11.6
162 12 2 0 27.809 55.618 0.303 6.85 4 210.0 61.7
163 2 0 6 27.839 55.679 0.303 6.83 2 22.4 0.4
164 13 1 -3 27.847 55.693 0.303 6.83 4 61.8 5.3
165 7 3 0 27.872 55.744 0.303 6.82 4 183.2 46.7
166 2 2 -5 27.916 55.833 0.304 6.79 4 33.1 1.5
167 0 2 5 27.988 55.975 0.305 6.75 4 131.9 24.0
168 7 3 -1 28.031 56.063 0.305 6.73 4 82.8 9.4
169 9 1 -5 28.038 56.076 0.305 6.72 4 49.0 3.3
170 13 1 2 28.084 56.167 0.306 6.7 4 360.1 177.5
171 1 3 -3 28.095 56.19 0.306 6.69 4 4.1 0.0
172 5 3 2 28.179 56.358 0.307 6.65 4 424.5 244.8
173 1 3 3 28.3 56.601 0.308 6.58 4 166.6 37.3
174 1 1 -6 28.322 56.645 0.308 6.57 4 46.6 2.9
175 6 0 -6 28.368 56.736 0.308 6.55 2 303.6 61.7
176 4 2 -5 28.389 56.777 0.309 6.54 4 119.9 19.2
177 3 3 -3 28.432 56.863 0.309 6.52 4 213.4 60.6
178 3 1 -6 28.454 56.908 0.309 6.5 4 93.5 11.6
179 7 3 1 28.51 57.019 0.31 6.48 4 13.8 0.3
180 12 2 -2 28.579 57.158 0.311 6.44 4 220.9 64.2
181 2 2 5 28.6 57.2 0.311 6.43 4 20.3 0.5
182 7 1 5 28.604 57.208 0.311 6.43 4 27.6 1.0
183 12 2 1 28.617 57.235 0.311 6.42 4 69.6 6.3
184 14 0 2 28.68 57.359 0.312 6.39 2 451.6 133.1
185 1 1 6 28.73 57.46 0.312 6.36 4 294.8 113.0
186 7 3 -2 28.978 57.957 0.314 6.24 4 309.6 122.2
187 3 3 3 29.04 58.081 0.315 6.21 4 244.1 75.6
188 4 0 6 29.057 58.114 0.315 6.2 2 77.3 3.8
189 5 1 -6 29.119 58.239 0.316 6.17 4 489.3 301.9
190 15 1 -1 29.272 58.545 0.317 6.1 4 35.5 1.6
191 5 3 -3 29.299 58.597 0.318 6.09 4 197.8 48.7
192 15 1 0 29.385 58.77 0.319 6.05 4 102.7 13.0
193 6 2 -5 29.387 58.774 0.319 6.05 4 108.4 14.5
194 10 2 3 29.416 58.833 0.319 6.03 4 91.8 10.4
195 3 1 6 29.662 59.325 0.321 5.92 4 520.5 327.8
196 4 2 5 29.731 59.463 0.322 5.89 4 81.9 8.1
197 10 2 -4 29.793 59.587 0.323 5.86 4 276.9 91.8
198 8 2 4 29.815 59.63 0.323 5.85 4 391.3 183.1
199 8 0 -6 29.827 59.654 0.323 5.85 2 236.6 33.4
200 7 3 2 29.911 59.822 0.324 5.81 4 198.5 46.8
201 15 1 -2 29.932 59.863 0.324 5.8 4 191.3 43.4
202 9 3 0 30.007 60.014 0.325 5.77 4 318.0 119.2
203 9 3 -1 30.093 60.187 0.325 5.73 4 142.6 23.8
204 12 2 -3 30.118 60.235 0.326 5.72 4 37.6 1.7
205 13 1 -4 30.145 60.29 0.326 5.71 4 218.5 55.7
206 16 0 0 30.159 60.319 0.326 5.71 2 236.7 32.7
207 11 1 4 30.174 60.348 0.326 5.7 4 272.2 86.2
208 12 2 2 30.179 60.359 0.326 5.7 4 188.9 41.5
209 15 1 1 30.265 60.529 0.327 5.66 4 4.2 0.0
210 5 3 3 30.29 60.58 0.327 5.65 4 162.8 30.6
211 7 1 -6 30.297 60.594 0.327 5.65 4 391.8 177.1
212 11 1 -5 30.357 60.715 0.328 5.62 4 101.9 11.9
213 13 1 3 30.461 60.921 0.329 5.58 4 83.5 7.9
214 14 0 -4 30.521 61.042 0.33 5.56 2 215.8 26.4
215 12 0 4 30.552 61.103 0.33 5.54 2 88.3 4.4
216 16 0 -2 30.633 61.265 0.331 5.51 2 405.3 92.5
217 7 3 -3 30.667 61.334 0.331 5.5 4 91.9 9.5
218 9 3 1 30.681 61.363 0.331 5.49 4 120.8 16.4
219 6 0 6 30.76 61.52 0.332 5.46 2 199.7 22.2
220 1 3 -4 30.772 61.544 0.332 5.46 4 55.8 3.5
221 8 2 -5 30.881 61.762 0.333 5.41 4 103.4 11.8
222 9 3 -2 30.936 61.873 0.334 5.39 4 126.4 17.6
223 3 3 -4 31.026 62.052 0.335 5.36 4 92.9 9.5
224 9 1 5 31.03 62.061 0.335 5.36 4 69.6 5.3
225 1 3 4 31.031 62.062 0.335 5.36 4 1.2 0.0
226 5 1 6 31.091 62.181 0.335 5.33 4 408.8 182.1
227 14 2 -1 31.16 62.32 0.336 5.31 4 50.0 2.7
228 14 2 0 31.237 62.473 0.337 5.28 4 99.4 10.7
229 15 1 -3 31.333 62.667 0.338 5.24 4 61.4 4.0
230 6 2 5 31.348 62.696 0.338 5.24 4 160.8 27.6
231 10 0 -6 31.751 63.502 0.342 5.09 2 36.8 0.7
232 5 3 -4 31.786 63.572 0.342 5.08 4 88.4 8.1
233 3 3 4 31.795 63.59 0.342 5.08 4 30.9 1.0
234 14 2 -2 31.828 63.656 0.342 5.07 4 419.3 182.0
235 15 1 2 31.873 63.745 0.343 5.05 4 206.2 43.9
236 9 1 -6 31.953 63.907 0.344 5.02 4 198.9 40.6
237 7 3 3 32.015 64.03 0.344 5.0 4 2.6 0.0
238 14 2 1 32.054 64.109 0.344 4.99 4 147.5 22.2
239 2 2 -6 32.063 64.126 0.345 4.98 4 47.7 2.3
240 9 3 2 32.088 64.176 0.345 4.98 4 26.9 0.7
241 0 2 6 32.192 64.384 0.346 4.94 4 136.0 18.7
242 12 2 -4 32.348 64.696 0.347 4.89 4 205.0 42.0
243 10 2 4 32.373 64.746 0.348 4.88 4 241.0 57.9
244 12 2 3 32.431 64.862 0.348 4.86 4 2.9 0.0
245 4 2 -6 32.435 64.871 0.348 4.86 4 146.3 21.3
246 9 3 -3 32.502 65.003 0.349 4.84 4 71.7 5.1
247 11 3 0 32.554 65.108 0.349 4.82 4 239.8 56.7
248 11 3 -1 32.574 65.148 0.349 4.82 4 253.7 63.3
249 16 0 2 32.675 65.35 0.35 4.78 2 302.2 44.6
250 2 2 6 32.819 65.638 0.352 4.74 4 35.7 1.2
251 10 2 -5 32.832 65.663 0.352 4.74 4 140.1 19.0
252 8 0 6 32.907 65.815 0.353 4.71 2 139.3 9.3
253 7 1 6 32.979 65.958 0.353 4.69 4 85.3 7.0
254 7 3 -4 33.032 66.065 0.354 4.67 4 109.2 11.4
255 5 3 4 33.046 66.092 0.354 4.67 4 216.3 44.6
256 13 1 -5 33.071 66.143 0.354 4.66 4 65.0 4.0
257 1 1 -7 33.196 66.392 0.355 4.63 4 5.4 0.0
258 14 2 -3 33.215 66.43 0.356 4.62 4 66.3 4.1
259 3 1 -7 33.254 66.507 0.356 4.61 4 28.8 0.8
260 11 3 1 33.261 66.522 0.356 4.61 4 168.3 26.6
261 17 1 -1 33.285 66.571 0.356 4.6 4 121.1 13.8
262 6 2 -6 33.3 66.599 0.356 4.6 4 205.9 39.8
263 11 3 -2 33.319 66.638 0.357 4.59 4 16.9 0.3
264 0 4 0 33.377 66.753 0.357 4.57 2 364.1 61.9
265 8 2 5 33.413 66.825 0.357 4.56 4 128.7 15.4
266 15 1 -4 33.425 66.85 0.358 4.56 4 4.1 0.0
267 17 1 0 33.452 66.905 0.358 4.55 4 350.0 113.9
268 13 1 4 33.457 66.914 0.358 4.55 4 65.7 4.0
269 14 2 2 33.584 67.167 0.359 4.51 4 452.0 188.4
270 2 4 0 33.622 67.244 0.359 4.5 4 178.2 29.2
271 1 1 7 33.63 67.26 0.359 4.5 4 86.1 6.8
272 0 4 1 33.736 67.473 0.36 4.47 4 182.1 30.3
273 5 1 -7 33.802 67.604 0.361 4.45 4 157.2 22.5
274 17 1 -2 33.838 67.677 0.361 4.44 4 80.2 5.8
275 11 1 5 33.842 67.685 0.361 4.44 4 112.5 11.5
276 2 4 -1 33.919 67.838 0.362 4.42 4 146.7 19.4
277 4 2 6 33.929 67.858 0.362 4.42 4 100.3 9.1
278 16 0 -4 34.024 68.049 0.363 4.39 2 36.0 0.6
279 1 3 -5 34.038 68.075 0.363 4.39 4 19.7 0.3
280 2 4 1 34.042 68.084 0.363 4.39 4 117.2 12.3
281 11 1 -6 34.053 68.106 0.363 4.38 4 81.0 5.9
282 14 0 4 34.058 68.116 0.364 4.38 2 6.7 0.0
283 12 0 -6 34.101 68.202 0.364 4.37 2 146.3 9.6
284 15 1 3 34.154 68.309 0.364 4.36 4 23.0 0.5
285 9 3 3 34.178 68.356 0.365 4.35 4 207.2 38.1
286 3 3 -5 34.217 68.434 0.365 4.34 4 165.2 24.2
287 17 1 1 34.334 68.667 0.366 4.31 4 96.9 8.3
288 1 3 5 34.344 68.688 0.366 4.31 4 95.6 8.0
289 4 4 0 34.353 68.707 0.366 4.31 4 59.9 3.2
290 18 0 0 34.417 68.834 0.367 4.29 2 104.0 4.7
291 3 1 7 34.547 69.094 0.368 4.26 4 90.5 7.1
292 4 4 -1 34.586 69.173 0.368 4.25 4 20.8 0.4
293 8 2 -6 34.637 69.275 0.369 4.23 4 214.9 40.0
294 11 3 2 34.672 69.344 0.369 4.22 4 81.2 5.7
295 18 0 -2 34.737 69.474 0.37 4.21 2 41.3 0.7
296 9 3 -4 34.739 69.478 0.37 4.21 4 259.8 58.0
297 7 3 4 34.757 69.514 0.37 4.2 4 82.1 5.8
298 11 3 -3 34.767 69.534 0.37 4.2 4 133.2 15.2
299 0 4 2 34.804 69.609 0.37 4.19 4 257.7 56.9
300 16 2 -1 34.811 69.623 0.371 4.19 4 208.1 37.1
301 7 1 -7 34.829 69.659 0.371 4.19 4 0.4 0.0
302 4 4 1 34.83 69.66 0.371 4.19 4 139.1 16.5
303 5 3 -5 34.88 69.759 0.371 4.17 4 252.2 54.2
304 2 4 -2 34.924 69.847 0.372 4.16 4 151.3 19.5
305 16 2 0 34.944 69.889 0.372 4.16 4 37.9 1.2
306 17 1 -3 35.094 70.189 0.373 4.12 4 21.5 0.4
307 3 3 5 35.131 70.262 0.374 4.11 4 260.4 57.0
308 2 4 2 35.166 70.332 0.374 4.11 4 111.6 10.4
309 12 2 -5 35.205 70.41 0.374 4.1 4 40.3 1.4
310 14 2 -4 35.279 70.558 0.375 4.08 4 76.5 4.9
311 9 1 6 35.294 70.588 0.375 4.08 4 89.3 6.6
312 12 2 4 35.308 70.616 0.375 4.07 4 103.0 8.8
313 16 2 -2 35.383 70.766 0.376 4.06 4 347.1 99.8
314 13 3 -1 35.438 70.876 0.376 4.04 4 139.2 16.0
315 10 0 6 35.464 70.928 0.377 4.04 2 142.1 8.3
316 13 3 0 35.479 70.959 0.377 4.03 4 2.3 0.0
317 6 2 6 35.501 71.003 0.377 4.03 4 108.4 9.7
318 4 4 -2 35.522 71.044 0.377 4.02 4 103.4 8.8
319 6 4 0 35.557 71.113 0.377 4.02 4 26.9 0.6
320 6 4 -1 35.726 71.452 0.379 3.98 4 101.2 8.3
321 16 2 1 35.779 71.557 0.38 3.97 4 185.3 27.8
322 14 2 3 35.781 71.562 0.38 3.97 4 108.4 9.5
323 10 2 5 35.892 71.784 0.381 3.94 4 106.1 9.1
324 17 1 2 35.905 71.81 0.381 3.94 4 10.1 0.1
325 5 1 7 35.929 71.859 0.381 3.93 4 69.3 3.9
326 4 4 2 36.003 72.006 0.382 3.92 4 5.7 0.0
327 7 3 -5 36.013 72.026 0.382 3.92 4 106.7 9.1
328 6 4 1 36.086 72.172 0.382 3.9 4 168.7 22.7
329 13 3 -2 36.095 72.19 0.382 3.9 4 219.9 38.5
330 15 1 -5 36.152 72.303 0.383 3.89 4 80.9 5.2
331 13 3 1 36.219 72.437 0.384 3.87 4 144.9 16.6
332 9 1 -7 36.318 72.636 0.384 3.85 4 67.7 3.6
333 5 3 5 36.385 72.77 0.385 3.84 4 82.1 5.3
334 10 2 -6 36.426 72.852 0.385 3.83 4 16.1 0.2
335 0 4 3 36.553 73.106 0.387 3.81 4 190.4 28.2
336 13 1 -6 36.566 73.131 0.387 3.8 4 210.3 34.4
337 6 4 -2 36.59 73.179 0.387 3.8 4 70.0 3.8
338 2 4 -3 36.61 73.221 0.387 3.79 4 290.9 65.6
339 2 2 -7 36.63 73.26 0.387 3.79 4 137.0 14.5
340 16 2 -3 36.645 73.29 0.387 3.79 4 176.9 24.2
341 11 3 3 36.751 73.502 0.388 3.77 4 162.1 20.2
342 0 2 7 36.811 73.621 0.389 3.76 4 155.7 18.6
343 14 0 -6 36.848 73.696 0.389 3.75 2 331.1 42.0
344 11 3 -4 36.88 73.761 0.39 3.74 4 190.0 27.6
345 18 0 2 36.9 73.8 0.39 3.74 2 136.1 7.1
346 9 3 4 36.902 73.804 0.39 3.74 4 213.1 34.7
347 4 2 -7 36.921 73.841 0.39 3.73 4 106.2 8.6
348 2 4 3 36.967 73.934 0.39 3.73 4 187.6 26.8
349 13 1 5 37.016 74.032 0.391 3.72 4 12.3 0.1
350 17 1 -4 37.022 74.045 0.391 3.72 4 173.1 22.7
351 15 1 4 37.057 74.114 0.391 3.71 4 151.2 17.3
352 4 4 -3 37.138 74.277 0.392 3.69 4 17.1 0.2
353 8 4 0 37.213 74.426 0.393 3.68 4 228.4 39.2
354 2 0 -8 37.231 74.462 0.393 3.68 2 507.2 96.6
355 16 2 2 37.294 74.589 0.393 3.67 4 204.2 31.2
356 6 4 2 37.302 74.603 0.393 3.66 4 53.4 2.1
357 8 4 -1 37.32 74.64 0.394 3.66 4 286.1 61.2
358 13 3 -3 37.436 74.872 0.395 3.64 4 171.9 22.0
359 2 2 7 37.46 74.92 0.395 3.64 4 69.0 3.5
360 4 0 -8 37.461 74.922 0.395 3.64 2 322.9 38.7
361 0 0 8 37.47 74.939 0.395 3.63 2 467.0 81.0
362 8 2 6 37.514 75.027 0.395 3.63 4 77.5 4.4
363 19 1 -1 37.536 75.071 0.395 3.62 4 45.1 1.5
364 9 3 -5 37.6 75.201 0.396 3.61 4 72.6 3.9
365 13 3 2 37.639 75.279 0.396 3.6 4 276.9 56.4
366 6 2 -7 37.679 75.357 0.397 3.6 4 43.2 1.4
367 19 1 0 37.753 75.506 0.397 3.59 4 517.5 196.2
368 7 1 7 37.758 75.517 0.397 3.58 4 59.3 2.6
369 8 4 1 37.792 75.584 0.398 3.58 4 305.5 68.2
370 18 0 -4 37.83 75.66 0.398 3.57 2 101.9 3.8
371 1 3 -6 37.845 75.69 0.398 3.57 4 93.5 6.4
372 4 4 3 37.847 75.693 0.398 3.57 4 11.7 0.1
373 16 0 4 37.866 75.733 0.398 3.57 2 170.4 10.6
374 3 3 -6 37.958 75.916 0.399 3.55 4 81.7 4.8
375 14 2 -5 37.977 75.955 0.399 3.55 4 51.5 1.9
376 19 1 -2 38.003 76.005 0.4 3.54 4 37.3 1.0
377 11 1 6 38.011 76.022 0.4 3.54 4 315.6 72.1
378 7 3 5 38.088 76.176 0.4 3.53 4 13.1 0.1
379 8 4 -2 38.112 76.223 0.401 3.53 4 33.2 0.8
380 6 4 -3 38.13 76.26 0.401 3.52 4 91.2 6.0
381 17 1 3 38.133 76.265 0.401 3.52 4 48.1 1.7
382 6 0 -8 38.157 76.313 0.401 3.52 2 96.7 3.4
383 2 0 8 38.174 76.347 0.401 3.52 2 3.6 0.0
384 1 3 6 38.197 76.395 0.401 3.51 4 148.3 15.8
385 11 1 -7 38.249 76.497 0.402 3.5 4 67.5 3.3
386 3 1 -8 38.406 76.812 0.403 3.48 4 121.1 10.4
387 12 0 6 38.409 76.818 0.403 3.48 2 358.0 45.5
388 1 1 -8 38.41 76.821 0.403 3.48 4 123.1 10.8
389 5 3 -6 38.536 77.072 0.404 3.46 4 321.7 73.1
390 4 2 7 38.57 77.14 0.405 3.45 4 9.9 0.1
391 16 2 -4 38.572 77.145 0.405 3.45 4 41.3 1.2
392 14 2 4 38.604 77.209 0.405 3.45 4 48.2 1.6
393 12 2 -6 38.645 77.29 0.405 3.44 4 82.4 4.8
394 19 1 1 38.651 77.302 0.405 3.44 4 79.4 4.4
395 15 3 -1 38.67 77.339 0.406 3.44 4 53.1 2.0
396 18 2 -1 38.76 77.52 0.406 3.42 4 52.8 2.0
397 12 2 5 38.766 77.533 0.406 3.42 4 94.9 6.3
398 15 3 0 38.768 77.537 0.406 3.42 4 110.1 8.5
399 5 1 -8 38.865 77.73 0.407 3.41 4 51.2 1.8
400 1 1 8 38.878 77.756 0.407 3.41 4 98.3 6.7
401 8 2 -7 38.895 77.789 0.408 3.4 4 48.1 1.6
402 20 0 0 38.904 77.807 0.408 3.4 2 69.9 1.7
403 18 2 0 38.946 77.892 0.408 3.4 4 177.0 21.7
404 2 4 -4 38.947 77.894 0.408 3.4 4 264.3 48.5
405 0 4 4 38.949 77.898 0.408 3.4 4 316.9 69.7
406 3 3 6 39.012 78.023 0.409 3.39 4 437.5 132.4
407 8 4 2 39.047 78.094 0.409 3.38 4 127.2 11.2
408 20 0 -2 39.093 78.185 0.409 3.38 2 73.9 1.9
409 19 1 -3 39.146 78.293 0.41 3.37 4 7.7 0.0
410 6 4 3 39.182 78.363 0.41 3.36 4 130.0 11.6
411 15 3 -2 39.249 78.498 0.411 3.35 4 88.3 5.3
412 18 2 -2 39.252 78.503 0.411 3.35 4 67.4 3.1
413 10 4 0 39.305 78.61 0.411 3.35 4 228.1 35.6
414 8 0 -8 39.31 78.62 0.411 3.35 2 93.3 3.0
415 4 0 8 39.335 78.671 0.411 3.34 2 106.6 3.9
416 10 4 -1 39.352 78.704 0.412 3.34 4 76.9 4.0
417 4 4 -4 39.406 78.813 0.412 3.33 4 119.2 9.7
418 2 4 4 39.413 78.825 0.412 3.33 4 76.1 3.9
419 13 3 -4 39.438 78.875 0.412 3.33 4 98.6 6.6
420 11 3 4 39.463 78.926 0.413 3.32 4 16.5 0.2
421 16 2 3 39.465 78.931 0.413 3.32 4 138.1 13.0
422 15 1 -6 39.474 78.949 0.413 3.32 4 222.6 33.6
423 15 3 1 39.543 79.087 0.413 3.31 4 43.0 1.3
424 7 3 -6 39.572 79.144 0.414 3.31 4 268.0 48.6
425 8 4 -3 39.574 79.148 0.414 3.31 4 191.1 24.7
426 17 1 -5 39.59 79.18 0.414 3.31 4 56.8 2.2
427 11 3 -5 39.626 79.251 0.414 3.3 4 142.5 13.7
428 13 3 3 39.717 79.435 0.415 3.29 4 124.1 10.3
429 7 1 -8 39.783 79.566 0.415 3.28 4 2.1 0.0
430 3 1 8 39.804 79.608 0.416 3.28 4 95.0 6.0
431 18 2 1 39.807 79.614 0.416 3.28 4 66.9 3.0
432 10 4 1 39.932 79.865 0.417 3.26 4 102.9 7.1
433 10 2 6 39.948 79.896 0.417 3.26 4 173.3 20.0
434 16 0 -6 39.979 79.959 0.417 3.26 2 516.0 88.6
435 9 1 7 40.017 80.034 0.417 3.25 4 2.4 0.0
436 10 4 -2 40.073 80.146 0.418 3.25 4 125.8 10.5
437 6 2 7 40.129 80.258 0.418 3.24 4 104.9 7.3
438 19 1 2 40.216 80.433 0.419 3.23 4 44.6 1.3
439 9 3 5 40.226 80.452 0.419 3.23 4 106.7 7.5
440 5 3 6 40.28 80.56 0.42 3.22 4 206.4 28.0
441 6 4 -4 40.323 80.646 0.42 3.22 4 124.7 10.2
442 4 4 4 40.333 80.667 0.42 3.21 4 47.9 1.5
443 18 2 -3 40.414 80.828 0.421 3.2 4 64.4 2.7
444 15 3 -3 40.498 80.996 0.422 3.19 4 12.4 0.1
445 15 1 5 40.55 81.1 0.422 3.19 4 43.3 1.2
446 10 2 -7 40.558 81.115 0.422 3.19 4 148.3 14.3
447 13 1 -7 40.606 81.213 0.422 3.18 4 11.1 0.1
448 10 0 -8 40.911 81.822 0.425 3.15 2 329.6 34.9
449 6 0 8 40.945 81.889 0.425 3.14 2 335.8 36.2
450 19 1 -4 40.951 81.902 0.425 3.14 4 408.2 107.0
451 8 4 3 40.961 81.922 0.426 3.14 4 177.6 20.2
452 15 3 2 40.985 81.969 0.426 3.14 4 79.5 4.0
453 17 1 4 40.989 81.978 0.426 3.14 4 342.0 75.0
454 9 3 -6 41.058 82.116 0.426 3.13 4 112.6 8.1
455 13 1 6 41.122 82.244 0.427 3.13 4 274.7 48.2
456 16 2 -5 41.14 82.281 0.427 3.12 4 143.4 13.1
457 9 1 -8 41.152 82.304 0.427 3.12 4 170.0 18.4
458 5 1 8 41.181 82.362 0.427 3.12 4 92.7 5.5
459 10 4 2 41.227 82.454 0.428 3.11 4 156.7 15.6
460 14 2 -6 41.282 82.565 0.428 3.11 4 305.8 59.4
461 18 2 2 41.333 82.665 0.429 3.1 4 86.5 4.7
462 20 0 2 41.406 82.811 0.429 3.1 2 140.6 6.3
463 10 4 -3 41.46 82.92 0.43 3.09 4 148.2 13.9
464 2 2 -8 41.654 83.307 0.431 3.07 4 393.2 97.0
465 8 4 -4 41.69 83.38 0.432 3.07 4 100.7 6.4
466 6 4 4 41.705 83.409 0.432 3.07 4 81.4 4.2
467 14 0 6 41.74 83.479 0.432 3.06 2 316.9 31.4
468 12 4 -1 41.811 83.621 0.433 3.06 4 21.1 0.3
469 12 4 0 41.821 83.643 0.433 3.05 4 160.9 16.2
470 4 2 -8 41.877 83.754 0.433 3.05 4 176.2 19.3
471 0 2 8 41.885 83.77 0.433 3.05 4 279.6 48.7
472 2 4 -5 41.911 83.821 0.434 3.05 4 205.9 26.4
473 20 0 -4 41.964 83.929 0.434 3.04 2 24.3 0.2
474 0 4 5 41.97 83.94 0.434 3.04 4 157.6 15.4
475 7 3 6 41.993 83.987 0.434 3.04 4 107.8 7.2
476 18 0 4 42.004 84.008 0.434 3.04 2 120.4 4.5
477 14 2 5 42.033 84.066 0.435 3.04 4 115.1 8.2
478 21 1 -1 42.077 84.154 0.435 3.03 4 89.5 5.0
479 13 3 -5 42.079 84.157 0.435 3.03 4 203.7 25.7
480 8 2 7 42.129 84.257 0.435 3.03 4 52.8 1.7
481 1 3 -7 42.193 84.386 0.436 3.02 4 44.1 1.2
482 18 2 -4 42.235 84.471 0.436 3.02 4 126.8 9.9
483 3 3 -7 42.246 84.492 0.436 3.02 4 118.1 8.6
484 16 2 4 42.271 84.542 0.437 3.01 4 110.0 7.5
485 17 3 -1 42.276 84.551 0.437 3.01 4 68.9 2.9
486 4 4 -5 42.306 84.611 0.437 3.01 4 70.7 3.1
487 21 1 0 42.346 84.691 0.437 3.01 4 280.2 48.2
488 15 3 -4 42.404 84.809 0.438 3.0 4 145.7 13.0
489 17 3 0 42.429 84.859 0.438 3.0 4 144.8 12.8
490 19 1 3 42.433 84.866 0.438 3.0 4 14.4 0.1
491 13 3 4 42.434 84.867 0.438 3.0 4 116.8 8.4
492 12 4 -2 42.466 84.932 0.438 3.0 4 140.1 12.0
493 21 1 -2 42.474 84.948 0.438 3.0 4 23.0 0.3
494 2 4 5 42.484 84.967 0.438 3.0 4 112.2 7.7
495 12 4 1 42.498 84.996 0.439 2.99 4 8.5 0.0
496 6 2 -8 42.554 85.108 0.439 2.99 4 122.8 9.2
497 2 2 8 42.57 85.141 0.439 2.99 4 7.3 0.0
498 1 3 7 42.594 85.188 0.439 2.99 4 165.0 16.6
499 12 2 -7 42.66 85.319 0.44 2.98 4 9.3 0.1
500 11 1 7 42.698 85.397 0.44 2.98 4 87.0 4.6
501 5 3 -7 42.753 85.506 0.441 2.97 4 145.9 12.9
502 17 1 -6 42.78 85.56 0.441 2.97 4 8.5 0.0
503 17 3 -2 42.787 85.574 0.441 2.97 4 106.8 6.9
504 11 3 5 42.79 85.581 0.441 2.97 4 161.5 15.8
505 12 2 6 42.8 85.6 0.441 2.97 4 209.2 26.5
506 12 0 -8 42.953 85.906 0.442 2.96 2 82.8 2.1
507 11 1 -8 42.965 85.931 0.442 2.96 4 322.9 63.0
508 11 3 -6 42.986 85.972 0.443 2.96 4 130.3 10.2
509 8 0 8 42.994 85.989 0.443 2.95 2 314.3 29.8
510 7 1 8 43.003 86.006 0.443 2.95 4 67.1 2.7
511 20 2 -1 43.044 86.089 0.443 2.95 4 45.7 1.3
512 15 3 3 43.08 86.161 0.443 2.95 4 18.0 0.2
513 6 4 -5 43.153 86.306 0.444 2.94 4 14.1 0.1
514 10 4 3 43.178 86.356 0.444 2.94 4 11.0 0.1
515 17 3 1 43.248 86.495 0.445 2.94 4 86.4 4.5
516 21 1 1 43.278 86.557 0.445 2.93 4 61.5 2.3
517 20 2 0 43.284 86.567 0.445 2.93 4 4.0 0.0
518 15 1 -7 43.387 86.774 0.446 2.93 4 2.1 0.0
519 19 1 -5 43.404 86.808 0.446 2.92 4 0.2 0.0
520 3 3 7 43.447 86.894 0.446 2.92 4 172.4 17.7
521 4 4 5 43.449 86.898 0.446 2.92 4 138.6 11.5
522 20 2 -2 43.469 86.938 0.447 2.92 4 122.2 8.9
523 10 4 -4 43.502 87.005 0.447 2.92 4 182.1 19.8
524 1 5 0 43.503 87.006 0.447 2.92 4 10.2 0.1
525 18 0 -6 43.504 87.008 0.447 2.92 2 117.4 4.1
526 18 2 3 43.512 87.023 0.447 2.92 4 19.6 0.2
527 8 4 4 43.521 87.042 0.447 2.92 4 241.5 34.7
528 21 1 -3 43.535 87.07 0.447 2.92 4 52.2 1.6
529 8 2 -8 43.682 87.364 0.448 2.9 4 148.5 13.1
530 22 0 0 43.694 87.389 0.448 2.9 2 29.0 0.2
531 4 2 8 43.707 87.414 0.449 2.9 4 180.3 19.3
532 7 3 -7 43.712 87.423 0.449 2.9 4 122.8 8.9
533 22 0 -2 43.765 87.531 0.449 2.9 2 342.5 34.7
534 12 4 -3 43.783 87.566 0.449 2.9 4 15.6 0.1
535 1 5 -1 43.806 87.612 0.449 2.9 4 109.8 7.1
536 12 4 2 43.837 87.674 0.45 2.89 4 141.5 11.8
537 1 5 1 43.863 87.726 0.45 2.89 4 46.6 1.3
538 3 5 0 43.955 87.911 0.451 2.89 4 133.5 10.5
539 17 3 -3 43.961 87.921 0.451 2.89 4 81.8 3.9
540 3 1 -9 44.011 88.022 0.451 2.88 4 41.1 1.0
541 1 1 -9 44.072 88.144 0.451 2.88 4 12.9 0.1
542 9 3 6 44.149 88.297 0.452 2.88 4 80.9 3.8
543 20 2 1 44.186 88.372 0.452 2.87 4 24.5 0.4
544 3 5 -1 44.201 88.403 0.453 2.87 4 166.0 16.2
545 16 2 -6 44.34 88.68 0.454 2.86 4 350.9 72.1
546 3 5 1 44.372 88.745 0.454 2.86 4 204.9 24.6
547 5 1 -9 44.402 88.803 0.454 2.86 4 75.4 3.3
548 8 4 -5 44.451 88.902 0.455 2.86 4 205.8 24.7
549 17 1 5 44.468 88.937 0.455 2.86 4 76.6 3.4
550 20 2 -3 44.556 89.112 0.455 2.85 4 41.0 1.0
551 10 2 7 44.566 89.133 0.456 2.85 4 34.2 0.7
552 1 1 9 44.585 89.17 0.456 2.85 4 112.1 7.3
553 15 1 6 44.64 89.279 0.456 2.85 4 90.3 4.7
554 14 4 -1 44.698 89.396 0.457 2.84 4 141.2 11.6
555 18 2 -5 44.708 89.417 0.457 2.84 4 69.9 2.8
556 17 3 2 44.727 89.455 0.457 2.84 4 123.2 8.8
557 5 3 7 44.751 89.501 0.457 2.84 4 60.5 2.1
558 14 4 0 44.766 89.531 0.457 2.84 4 187.1 20.3
559 1 5 -2 44.772 89.544 0.457 2.84 4 2.0 0.0
560 5 5 0 44.86 89.719 0.458 2.84 4 188.4 20.6
561 6 4 5 44.865 89.729 0.458 2.84 4 149.1 12.9
562 21 1 2 44.872 89.744 0.458 2.83 4 49.3 1.4
563 1 5 2 44.886 89.772 0.458 2.83 4 57.2 1.9
564 15 3 -5 44.962 89.924 0.459 2.83 4 54.8 1.7
X-ray diffraction powder data (I)...X-Ray wave length = 1.54056 (angs.):
No H K L Theta 2*Theta d I int I int.n. I p.h.n. H(Si)
( degree ) (angstrem) *100 *100
1 2 0 0 3.601 7.201 12.26539 9757.7 100.0 100.0 5.5
2 4 0 0 7.216 14.431 6.1327 601.7 6.2 6.1 5.6
3 1 1 0 8.11 16.22 5.4601 839.2 8.6 8.6 5.6
4 1 1 -1 9.132 18.263 4.85357 339.0 3.5 3.5 5.6
5 1 1 1 9.312 18.624 4.76045 193.7 2.0 2.0 5.6
6 3 1 -1 10.318 20.636 4.30064 109.5 1.1 1.1 5.6
7 3 1 1 10.793 21.585 4.1135 235.1 2.4 2.4 5.6
8 5 1 0 12.048 24.095 3.69042 152.6 1.6 1.5 5.6
9 1 1 2 12.112 24.224 3.67104 159.6 1.6 1.6 5.6
10 5 1 -1 12.502 25.004 3.55831 350.4 3.6 3.6 5.6
11 3 1 -2 12.647 25.294 3.51823 1111.8 11.4 11.3 5.6
12 5 1 1 13.16 26.32 3.38324 159.0 1.6 1.6 5.6
13 6 0 -2 13.266 26.531 3.35681 938.0 9.6 9.5 5.6
14 3 1 2 13.425 26.85 3.31768 2280.0 23.4 23.1 5.6
15 5 1 -2 14.385 28.77 3.10052 3256.1 33.4 32.9 5.6
16 8 0 0 14.549 29.098 3.06635 1022.5 10.5 10.3 5.6
17 6 0 2 14.724 29.447 3.03072 480.9 4.9 4.9 5.6
18 7 1 0 15.028 30.056 2.97076 122.8 1.3 1.2 5.6
19 5 1 2 15.528 31.057 2.87725 2378.6 24.4 24.0 5.6
20 1 1 3 15.723 31.447 2.84244 108.7 1.1 1.1 5.6
21 0 2 0 15.966 31.932 2.8003 1065.3 10.9 10.7 5.6
22 2 2 0 16.388 32.777 2.73005 668.3 6.8 6.7 5.6
23 0 2 1 16.582 33.164 2.69906 259.0 2.7 2.6 5.6
24 7 1 -2 16.785 33.57 2.66735 494.2 5.1 5.0 5.7
25 2 2 -1 16.888 33.777 2.65149 113.1 1.2 1.1 5.7
26 0 0 4 17.708 35.417 2.53239 1555.4 15.9 15.6 5.7
27 7 1 2 18.178 36.356 2.46909 273.4 2.8 2.7 5.7
28 9 1 0 18.318 36.637 2.45082 569.4 5.8 5.7 5.7
29 5 1 3 18.726 37.452 2.39928 99.4 1.0 1.0 5.7
30 4 2 -2 19.424 38.847 2.31628 156.1 1.6 1.6 5.7
31 9 1 -2 19.639 39.278 2.29189 212.6 2.2 2.1 5.7
32 11 1 0 21.826 43.651 2.07186 359.6 3.7 3.6 5.7
33 8 2 0 21.871 43.742 2.06778 622.5 6.4 6.2 5.7
34 6 0 4 21.969 43.938 2.05898 642.6 6.6 6.4 5.7
35 7 1 -4 22.449 44.898 2.01717 155.3 1.6 1.5 5.7
36 8 2 -2 23.101 46.201 1.96326 119.0 1.2 1.2 5.7
37 2 2 -4 24.208 48.417 1.87847 1222.5 12.5 12.1 5.7
38 10 0 -4 24.443 48.886 1.86155 492.6 5.0 4.9 5.7
39 11 1 2 24.525 49.05 1.85571 242.2 2.5 2.4 5.7
40 9 1 -4 24.608 49.215 1.84985 204.4 2.1 2.0 5.7
41 10 2 0 24.674 49.347 1.84521 234.1 2.4 2.3 5.7
42 2 2 4 24.813 49.625 1.83552 277.6 2.8 2.7 5.7
43 12 0 2 24.884 49.767 1.83061 124.5 1.3 1.2 5.7
44 3 3 -1 25.357 50.714 1.79862 171.9 1.8 1.7 5.8
45 5 3 0 26.198 52.395 1.74482 109.3 1.1 1.1 5.8
46 13 1 -2 26.259 52.518 1.74103 218.3 2.2 2.2 5.8
47 3 3 -2 26.512 53.024 1.72558 181.4 1.9 1.8 5.8
48 14 0 -2 26.74 53.481 1.71193 236.3 2.4 2.3 5.8
49 3 3 2 26.938 53.876 1.7003 266.4 2.7 2.6 5.8
50 10 2 2 27.087 54.175 1.69162 105.1 1.1 1.0 5.8
51 11 1 -4 27.194 54.388 1.68551 372.1 3.8 3.7 5.8
52 10 0 4 27.346 54.693 1.67682 179.8 1.8 1.8 5.8
53 5 3 -2 27.489 54.977 1.66882 224.8 2.3 2.2 5.8
54 8 2 -4 27.65 55.301 1.65981 153.4 1.6 1.5 5.8
55 13 1 2 28.084 56.167 1.63625 177.5 1.8 1.7 5.8
56 5 3 2 28.179 56.358 1.63116 244.8 2.5 2.4 5.8
57 14 0 2 28.68 57.359 1.60504 133.1 1.4 1.3 5.8
58 1 1 6 28.73 57.46 1.60247 113.0 1.2 1.1 5.8
59 7 3 -2 28.978 57.957 1.58991 122.2 1.3 1.2 5.8
60 5 1 -6 29.119 58.239 1.58288 301.9 3.1 3.0 5.8
61 3 1 6 29.662 59.325 1.55647 327.8 3.4 3.2 5.8
62 8 2 4 29.815 59.63 1.54924 308.4 3.2 3.0 5.8
63 9 3 0 30.007 60.014 1.54022 119.2 1.2 1.2 5.8
64 11 1 4 30.174 60.348 1.53251 216.1 2.2 2.1 5.8
65 7 1 -6 30.297 60.594 1.52687 207.7 2.1 2.0 5.8
66 5 1 6 31.091 62.181 1.49166 182.1 1.9 1.8 5.8
67 14 2 -2 31.828 63.656 1.46061 182.0 1.9 1.8 5.9
68 10 2 4 32.373 64.746 1.43862 99.9 1.0 1.0 5.9
69 11 3 -1 32.574 65.148 1.43072 120.0 1.2 1.2 5.9
70 17 1 0 33.452 66.905 1.39735 117.9 1.2 1.1 5.9
71 14 2 2 33.584 67.167 1.39252 188.4 1.9 1.8 5.9
72 0 4 2 34.804 69.609 1.34953 110.5 1.1 1.1 5.9
73 16 2 -2 35.383 70.766 1.33027 99.8 1.0 1.0 5.9
74 2 0 -8 37.231 74.462 1.27312 135.9 1.4 1.3 6.0
75 0 0 8 37.47 74.939 1.2662 145.2 1.5 1.4 6.0
76 19 1 0 37.753 75.506 1.2581 198.7 2.0 1.9 6.0
77 0 4 4 38.949 77.898 1.22533 139.9 1.4 1.3 6.0
78 3 3 6 39.012 78.023 1.22368 132.4 1.4 1.3 6.0
79 19 1 -4 40.951 81.902 1.17526 163.4 1.7 1.5 6.1
80 11 1 -8 42.965 85.931 1.13018 107.8 1.1 1.0 6.1
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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