| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
D |
157 |
40 |
10196 |
◊ |
C |
x,y,z |
1_555 |
153 |
39 |
10437 |
1445.3 |
-20.6 |
0.028 |
14 |
0 |
0 |
0.408 |
2 |
|
J |
154 |
39 |
10400 |
◊ |
I |
x,y,z |
1_555 |
154 |
40 |
10562 |
1430.6 |
-22.0 |
0.011 |
15 |
0 |
0 |
0.408 |
3 |
|
L |
150 |
39 |
10307 |
◊ |
K |
x,y,z |
1_555 |
153 |
38 |
10392 |
1416.8 |
-20.8 |
0.026 |
15 |
0 |
0 |
0.408 |
4 |
|
B |
153 |
38 |
10237 |
◊ |
A |
x,y,z |
1_555 |
153 |
39 |
10303 |
1415.4 |
-21.5 |
0.015 |
15 |
0 |
0 |
0.408 |
5 |
|
H |
146 |
39 |
10244 |
◊ |
G |
x,y,z |
1_555 |
149 |
39 |
10469 |
1406.1 |
-20.9 |
0.016 |
14 |
0 |
0 |
0.408 |
6 |
|
F |
145 |
39 |
10407 |
◊ |
E |
x,y,z |
1_555 |
139 |
38 |
10373 |
1373.4 |
-20.8 |
0.015 |
15 |
0 |
0 |
0.408 |
| Average: |
1414.6 |
-21.1 |
0.018 |
15 |
0 |
0 |
0.408 |
| 2 |
7 |
|
J |
57 |
16 |
10400 |
◊ |
G |
x,y,z |
1_555 |
53 |
12 |
10469 |
528.2 |
-2.5 |
0.468 |
5 |
4 |
0 |
0.000 |
| 3 |
8 |
|
L |
54 |
19 |
10307 |
◊ |
I |
x,y,z |
1_555 |
59 |
15 |
10562 |
523.0 |
-1.6 |
0.552 |
7 |
1 |
0 |
0.040 |
9 |
|
K |
53 |
16 |
10392 |
◊ |
J |
x,y,z |
1_555 |
55 |
18 |
10400 |
520.5 |
-0.6 |
0.588 |
7 |
4 |
0 |
0.040 |
10 |
|
C |
52 |
18 |
10437 |
◊ |
B |
x,y,z |
1_555 |
53 |
19 |
10237 |
494.4 |
0.1 |
0.603 |
5 |
2 |
0 |
0.040 |
11 |
|
H |
53 |
14 |
10244 |
◊ |
E |
-y-1,x-y-2,z-1/3 |
2_434 |
49 |
20 |
10373 |
489.1 |
-1.2 |
0.553 |
6 |
1 |
0 |
0.040 |
12 |
|
D |
51 |
19 |
10196 |
◊ |
A |
x,y,z |
1_555 |
51 |
15 |
10303 |
478.0 |
-2.2 |
0.468 |
7 |
1 |
0 |
0.040 |
13 |
|
G |
51 |
18 |
10469 |
◊ |
F |
-y-1,x-y-2,z-1/3 |
2_434 |
50 |
14 |
10407 |
473.0 |
-0.1 |
0.584 |
6 |
2 |
0 |
0.040 |
| Average: |
496.3 |
-0.9 |
0.558 |
6 |
2 |
0 |
0.040 |
| 4 |
14 |
|
A |
43 |
13 |
10303 |
◊ |
I |
-y-2,x-y-1,z-1/3 |
2_344 |
46 |
14 |
10562 |
462.4 |
-1.9 |
0.473 |
6 |
0 |
0 |
0.000 |
| 5 |
15 |
|
I |
51 |
18 |
10562 |
◊ |
L |
-y-2,x-y-2,z-1/3 |
2_334 |
52 |
18 |
10307 |
462.3 |
0.2 |
0.619 |
5 |
2 |
0 |
0.000 |
16 |
|
D |
51 |
17 |
10196 |
◊ |
A |
-y-1,x-y-1,z-1/3 |
2_444 |
49 |
17 |
10303 |
448.3 |
0.8 |
0.646 |
5 |
1 |
0 |
0.000 |
| Average: |
455.3 |
0.5 |
0.632 |
5 |
2 |
0 |
0.000 |
| 6 |
17 |
|
D |
44 |
10 |
10196 |
◊ |
G |
-y-2,x-y-2,z-1/3 |
2_334 |
49 |
14 |
10469 |
395.8 |
2.3 |
0.825 |
3 |
3 |
0 |
0.000 |
| 7 |
18 |
|
L |
42 |
10 |
10307 |
◊ |
D |
-y-1,x-y-1,z+2/3 |
2_445 |
47 |
13 |
10196 |
389.1 |
-2.4 |
0.480 |
3 |
2 |
0 |
0.000 |
| 8 |
19 |
|
E |
33 |
11 |
10373 |
◊ |
L |
-y-1,x-y-1,z-1/3 |
2_444 |
41 |
14 |
10307 |
380.2 |
-2.5 |
0.416 |
4 |
4 |
0 |
0.000 |
| 9 |
20 |
|
K |
39 |
12 |
10392 |
◊ |
I |
x,y,z |
1_555 |
35 |
11 |
10562 |
310.0 |
-0.1 |
0.643 |
3 |
2 |
0 |
0.007 |
21 |
|
C |
33 |
11 |
10437 |
◊ |
A |
x,y,z |
1_555 |
34 |
10 |
10303 |
270.1 |
-2.0 |
0.419 |
2 |
0 |
0 |
0.007 |
22 |
|
H |
31 |
9 |
10244 |
◊ |
F |
-y-1,x-y-2,z-1/3 |
2_434 |
36 |
11 |
10407 |
261.5 |
-1.8 |
0.441 |
2 |
0 |
0 |
0.007 |
| Average: |
280.6 |
-1.3 |
0.501 |
2 |
1 |
0 |
0.007 |
| 10 |
23 |
|
B |
29 |
10 |
10237 |
◊ |
E |
x-1,y,z |
1_455 |
31 |
10 |
10373 |
297.6 |
-4.2 |
0.199 |
3 |
0 |
0 |
0.000 |
| 11 |
24 |
|
A |
32 |
12 |
10303 |
◊ |
F |
-y-1,x-y-1,z-1/3 |
2_444 |
32 |
11 |
10407 |
295.7 |
-1.3 |
0.506 |
5 |
3 |
0 |
0.000 |
| 12 |
25 |
|
J |
29 |
9 |
10400 |
◊ |
B |
x,y,z |
1_555 |
31 |
11 |
10237 |
279.9 |
-2.2 |
0.386 |
2 |
3 |
0 |
0.000 |
| 13 |
26 |
|
J |
27 |
10 |
10400 |
◊ |
L |
-y-2,x-y-2,z-1/3 |
2_334 |
26 |
11 |
10307 |
263.2 |
-3.6 |
0.180 |
1 |
0 |
0 |
0.000 |
27 |
|
D |
26 |
10 |
10196 |
◊ |
B |
-y-1,x-y-1,z-1/3 |
2_444 |
25 |
10 |
10237 |
227.2 |
-3.6 |
0.163 |
1 |
0 |
0 |
0.000 |
| Average: |
245.2 |
-3.6 |
0.171 |
1 |
0 |
0 |
0.000 |
| 14 |
28 |
|
H |
27 |
9 |
10244 |
◊ |
I |
-y-1,x-y-1,z-1/3 |
2_444 |
30 |
9 |
10562 |
258.6 |
-0.6 |
0.558 |
2 |
0 |
0 |
0.000 |
| 15 |
29 |
|
G |
20 |
8 |
10469 |
◊ |
E |
x,y,z |
1_555 |
19 |
8 |
10373 |
220.3 |
-4.0 |
0.093 |
0 |
0 |
0 |
0.000 |
30 |
|
H |
15 |
7 |
10244 |
◊ |
F |
x,y,z |
1_555 |
16 |
7 |
10407 |
176.9 |
-3.8 |
0.063 |
0 |
0 |
0 |
0.000 |
| Average: |
198.6 |
-3.9 |
0.078 |
0 |
0 |
0 |
0.000 |
| 16 |
31 |
|
H |
22 |
7 |
10244 |
◊ |
C |
x,y,z |
1_555 |
25 |
8 |
10437 |
205.4 |
-1.3 |
0.463 |
1 |
0 |
0 |
0.000 |
| 17 |
32 |
|
I |
16 |
6 |
10562 |
◊ |
K |
-y-2,x-y-2,z-1/3 |
2_334 |
17 |
9 |
10392 |
194.3 |
-2.9 |
0.164 |
0 |
0 |
0 |
0.000 |
33 |
|
C |
15 |
8 |
10437 |
◊ |
A |
-y-1,x-y-1,z-1/3 |
2_444 |
16 |
7 |
10303 |
186.4 |
-3.1 |
0.112 |
0 |
0 |
0 |
0.000 |
| Average: |
190.3 |
-3.0 |
0.138 |
0 |
0 |
0 |
0.000 |
| 18 |
34 |
|
G |
22 |
5 |
10469 |
◊ |
F |
x,y,z |
1_555 |
22 |
5 |
10407 |
180.3 |
2.2 |
0.851 |
3 |
0 |
0 |
0.000 |
| 19 |
35 |
|
C |
23 |
6 |
10437 |
◊ |
K |
-y-2,x-y-2,z-1/3 |
2_334 |
17 |
7 |
10392 |
179.7 |
0.5 |
0.635 |
2 |
2 |
0 |
0.000 |
| 20 |
36 |
|
H |
18 |
8 |
10244 |
◊ |
E |
x,y,z |
1_555 |
17 |
8 |
10373 |
172.4 |
-2.3 |
0.217 |
0 |
0 |
0 |
0.000 |
| 21 |
37 |
|
K |
16 |
5 |
10392 |
◊ |
F |
x,y,z |
1_555 |
14 |
5 |
10407 |
160.2 |
1.3 |
0.647 |
2 |
3 |
0 |
0.000 |
| 22 |
38 |
|
[PO4]B:1630 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
10237 |
122.8 |
-8.0 |
0.746 |
5 |
0 |
0 |
0.099 |
| 23 |
39 |
|
[PO4]I:1655 |
5 |
1 |
188 |
f |
I |
x,y,z |
1_555 |
22 |
8 |
10562 |
119.5 |
-7.2 |
0.724 |
4 |
0 |
0 |
0.079 |
| 24 |
40 |
|
B |
16 |
5 |
10237 |
◊ |
I |
-y-2,x-y-1,z-1/3 |
2_344 |
13 |
4 |
10562 |
118.8 |
-0.2 |
0.593 |
1 |
0 |
0 |
0.000 |
| 25 |
41 |
|
J |
10 |
2 |
10400 |
◊ |
E |
x-1,y,z |
1_455 |
11 |
3 |
10373 |
118.7 |
2.0 |
0.877 |
3 |
4 |
0 |
0.000 |
| 26 |
42 |
|
[PO4]H:1617 |
5 |
1 |
189 |
f |
H |
x,y,z |
1_555 |
22 |
8 |
10244 |
118.0 |
-7.3 |
0.734 |
3 |
0 |
0 |
0.130 |
| 27 |
43 |
|
B |
9 |
3 |
10237 |
◊ |
L |
-y-2,x-y-1,z-1/3 |
2_344 |
15 |
4 |
10307 |
116.2 |
0.9 |
0.776 |
2 |
5 |
0 |
0.000 |
| 28 |
44 |
|
[PO4]K:1620 |
5 |
1 |
189 |
f |
K |
x,y,z |
1_555 |
21 |
9 |
10392 |
113.5 |
-7.3 |
0.634 |
3 |
0 |
0 |
0.086 |
| 29 |
45 |
|
[PO4]B:1651 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
10237 |
113.2 |
-7.9 |
0.656 |
4 |
0 |
0 |
0.093 |
| 30 |
46 |
|
[PO4]J:1603 |
5 |
1 |
189 |
f |
J |
x,y,z |
1_555 |
19 |
8 |
10400 |
111.9 |
-6.9 |
0.707 |
5 |
0 |
0 |
0.080 |
| 31 |
47 |
|
[PO4]C:1619 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
19 |
9 |
10437 |
110.7 |
-7.2 |
0.616 |
3 |
0 |
0 |
0.080 |
| 32 |
48 |
|
[PO4]D:1660 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
21 |
8 |
10196 |
110.6 |
-7.4 |
0.674 |
2 |
0 |
0 |
0.078 |
| 33 |
49 |
|
[PO4]F:1636 |
5 |
1 |
189 |
f |
F |
x,y,z |
1_555 |
16 |
6 |
10407 |
105.5 |
-7.0 |
0.722 |
4 |
0 |
0 |
0.069 |
| 34 |
50 |
|
[PO4]L:1622 |
5 |
1 |
188 |
f |
L |
x,y,z |
1_555 |
14 |
5 |
10307 |
103.8 |
-7.0 |
0.577 |
3 |
0 |
0 |
0.083 |
| 35 |
51 |
|
[PO4]I:1632 |
5 |
1 |
188 |
f |
I |
x,y,z |
1_555 |
15 |
6 |
10562 |
102.8 |
-7.1 |
0.557 |
1 |
0 |
0 |
0.066 |
| 36 |
52 |
|
[PO4]F:1618 |
5 |
1 |
188 |
f |
F |
x,y,z |
1_555 |
15 |
5 |
10407 |
101.6 |
-6.9 |
0.661 |
2 |
0 |
0 |
0.062 |
| 37 |
53 |
|
[PO4]A:1616 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
10303 |
101.5 |
-6.4 |
0.720 |
2 |
0 |
0 |
0.070 |
| 38 |
54 |
|
[PO4]I:1645 |
5 |
1 |
189 |
f |
I |
x,y,z |
1_555 |
14 |
5 |
10562 |
100.7 |
-5.4 |
0.733 |
2 |
0 |
0 |
0.055 |
| 39 |
55 |
|
[PO4]F:1640 |
5 |
1 |
190 |
f |
F |
x,y,z |
1_555 |
13 |
5 |
10407 |
98.9 |
-6.3 |
0.764 |
3 |
0 |
0 |
0.060 |
| 40 |
56 |
|
[PO4]I:1665 |
5 |
1 |
188 |
f |
I |
x,y,z |
1_555 |
14 |
5 |
10562 |
96.9 |
-5.3 |
0.855 |
3 |
0 |
0 |
0.058 |
| 41 |
57 |
|
[PO4]F:1628 |
5 |
1 |
189 |
f |
F |
x,y,z |
1_555 |
13 |
3 |
10407 |
93.7 |
-3.6 |
0.925 |
3 |
0 |
0 |
0.039 |
| 42 |
58 |
|
[PO4]B:1670 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
10237 |
92.4 |
-3.7 |
0.931 |
1 |
0 |
0 |
0.040 |
| 43 |
59 |
|
[PO4]D:1657 |
5 |
1 |
189 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
10196 |
91.7 |
-6.3 |
0.684 |
7 |
0 |
0 |
0.088 |
| 44 |
60 |
|
[PO4]E:1644 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
13 |
5 |
10373 |
91.2 |
-6.2 |
0.673 |
5 |
0 |
0 |
0.067 |
| 45 |
61 |
|
[PO4]J:1614 |
5 |
1 |
187 |
f |
J |
x,y,z |
1_555 |
15 |
5 |
10400 |
90.1 |
-6.2 |
0.659 |
5 |
0 |
0 |
0.074 |
| 46 |
62 |
|
[PO4]D:1659 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
13 |
4 |
10196 |
90.0 |
-4.3 |
0.842 |
2 |
0 |
0 |
0.049 |
| 47 |
63 |
|
[PO4]A:1626 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
10303 |
89.3 |
-6.3 |
0.691 |
4 |
0 |
0 |
0.078 |
| 48 |
64 |
|
[PO4]C:1663 |
5 |
1 |
189 |
f |
C |
x,y,z |
1_555 |
14 |
7 |
10437 |
89.2 |
-4.9 |
0.832 |
2 |
0 |
0 |
0.054 |
| 49 |
65 |
|
[PO4]B:1677 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
10237 |
88.4 |
-5.2 |
0.818 |
2 |
0 |
0 |
0.058 |
| 50 |
66 |
|
[PO4]L:1609 |
5 |
1 |
188 |
f |
L |
x,y,z |
1_555 |
10 |
5 |
10307 |
87.9 |
-4.1 |
0.902 |
4 |
0 |
0 |
0.059 |
| 51 |
67 |
|
[PO4]K:1601 |
5 |
1 |
188 |
f |
K |
x,y,z |
1_555 |
15 |
5 |
10392 |
87.4 |
-6.1 |
0.703 |
3 |
0 |
0 |
0.073 |
| 52 |
68 |
|
[PO4]F:1675 |
5 |
1 |
188 |
f |
F |
x,y,z |
1_555 |
13 |
6 |
10407 |
87.0 |
-5.6 |
0.756 |
2 |
0 |
0 |
0.051 |
| 53 |
69 |
|
[PO4]C:1607 |
5 |
1 |
189 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
10437 |
86.4 |
-6.2 |
0.650 |
3 |
0 |
0 |
0.071 |
| 54 |
70 |
|
[PO4]L:1656 |
5 |
1 |
188 |
f |
L |
x,y,z |
1_555 |
15 |
5 |
10307 |
84.7 |
-5.5 |
0.746 |
2 |
0 |
0 |
0.063 |
| 55 |
71 |
|
[PO4]G:1678 |
5 |
1 |
191 |
f |
G |
x,y,z |
1_555 |
11 |
4 |
10469 |
83.0 |
-5.6 |
0.627 |
2 |
0 |
0 |
0.097 |
| 56 |
72 |
|
[PO4]F:1627 |
5 |
1 |
190 |
f |
F |
x,y,z |
1_555 |
11 |
4 |
10407 |
82.2 |
-5.8 |
0.683 |
4 |
0 |
0 |
0.060 |
| 57 |
73 |
|
[PO4]J:1668 |
5 |
1 |
188 |
f |
J |
x,y,z |
1_555 |
13 |
4 |
10400 |
80.3 |
-5.3 |
0.688 |
1 |
0 |
0 |
0.051 |
| 58 |
74 |
|
[PO4]L:1602 |
5 |
1 |
187 |
f |
L |
x,y,z |
1_555 |
11 |
3 |
10307 |
80.2 |
-4.0 |
0.903 |
6 |
0 |
0 |
0.066 |
| 59 |
75 |
|
[PO4]A:1615 |
5 |
1 |
190 |
f |
C |
x,y,z |
1_555 |
11 |
3 |
10437 |
80.2 |
-3.7 |
0.883 |
2 |
0 |
0 |
0.043 |
| 60 |
76 |
|
[PO4]A:1641 |
5 |
1 |
190 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
10237 |
78.8 |
-6.3 |
0.349 |
2 |
0 |
0 |
0.069 |
| 61 |
77 |
|
[PO4]F:1650 |
5 |
1 |
187 |
f |
F |
x,y,z |
1_555 |
12 |
4 |
10407 |
78.6 |
-4.9 |
0.727 |
2 |
0 |
0 |
0.046 |
| 62 |
78 |
|
[PO4]A:1641 |
5 |
1 |
190 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
10303 |
76.5 |
-5.7 |
0.432 |
1 |
0 |
0 |
0.059 |
| 63 |
79 |
|
[PO4]F:1605 |
5 |
1 |
189 |
f |
G |
x,y,z |
1_555 |
11 |
3 |
10469 |
76.1 |
-3.0 |
0.893 |
1 |
0 |
0 |
0.051 |
| 64 |
80 |
|
[PO4]G:1654 |
5 |
1 |
188 |
f |
G |
x,y,z |
1_555 |
8 |
4 |
10469 |
76.0 |
-4.1 |
0.840 |
2 |
0 |
0 |
0.075 |
| 65 |
81 |
|
[PO4]K:1661 |
5 |
1 |
187 |
f |
K |
x,y,z |
1_555 |
12 |
4 |
10392 |
75.6 |
-5.0 |
0.681 |
1 |
0 |
0 |
0.054 |
| 66 |
82 |
|
[PO4]F:1635 |
5 |
1 |
190 |
f |
E |
x,y,z |
1_555 |
15 |
4 |
10373 |
75.5 |
-4.5 |
0.743 |
1 |
0 |
0 |
0.039 |
| 67 |
83 |
|
[PO4]D:1658 |
4 |
1 |
191 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
10196 |
75.0 |
-3.9 |
0.809 |
2 |
0 |
0 |
0.045 |
| 68 |
84 |
|
I |
6 |
2 |
10562 |
◊ |
F |
x-1,y,z |
1_455 |
11 |
2 |
10407 |
74.7 |
1.3 |
0.834 |
1 |
1 |
0 |
0.000 |
| 69 |
85 |
|
[PO4]I:1621 |
4 |
1 |
188 |
f |
I |
x,y,z |
1_555 |
8 |
3 |
10562 |
74.3 |
-3.1 |
0.852 |
4 |
0 |
0 |
0.043 |
| 70 |
86 |
|
[PO4]F:1611 |
5 |
1 |
190 |
◊ |
F |
x,y,z |
1_555 |
11 |
3 |
10407 |
74.0 |
-3.4 |
0.897 |
3 |
0 |
0 |
0.000 |
| 71 |
87 |
|
[PO4]E:1624 |
4 |
1 |
190 |
f |
E |
x,y,z |
1_555 |
10 |
5 |
10373 |
72.9 |
-4.2 |
0.765 |
2 |
0 |
0 |
0.040 |
| 72 |
88 |
|
[PO4]K:1673 |
5 |
1 |
187 |
f |
F |
x,y,z |
1_555 |
11 |
6 |
10407 |
72.5 |
-4.5 |
0.633 |
1 |
0 |
0 |
0.039 |
| 73 |
89 |
|
[PO4]C:1612 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
10437 |
72.4 |
-4.9 |
0.636 |
3 |
0 |
0 |
0.059 |
| 74 |
90 |
|
[PO4]H:1631 |
5 |
1 |
188 |
f |
H |
x,y,z |
1_555 |
12 |
4 |
10244 |
72.2 |
-3.9 |
0.808 |
2 |
0 |
0 |
0.072 |
| 75 |
91 |
|
[PO4]L:1666 |
5 |
1 |
189 |
f |
L |
x,y,z |
1_555 |
10 |
5 |
10307 |
70.5 |
-3.4 |
0.878 |
2 |
0 |
0 |
0.043 |
| 76 |
92 |
|
C |
10 |
3 |
10437 |
f |
[PO4]K:1610 |
-y-2,x-y-2,z-1/3 |
2_334 |
5 |
1 |
188 |
69.6 |
-3.5 |
0.863 |
4 |
0 |
0 |
0.049 |
| 77 |
93 |
|
[PO4]K:1673 |
5 |
1 |
187 |
◊ |
K |
x,y,z |
1_555 |
9 |
5 |
10392 |
68.5 |
-4.4 |
0.574 |
1 |
0 |
0 |
0.000 |
| 78 |
94 |
|
[PO4]K:1608 |
5 |
1 |
189 |
f |
F |
x,y,z |
1_555 |
11 |
4 |
10407 |
67.8 |
-4.6 |
0.570 |
1 |
0 |
0 |
0.040 |
| 79 |
95 |
|
[PO4]J:1633 |
4 |
1 |
188 |
f |
J |
x,y,z |
1_555 |
8 |
4 |
10400 |
67.7 |
-3.8 |
0.794 |
2 |
0 |
0 |
0.042 |
| 80 |
96 |
|
[PO4]B:1638 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
10237 |
66.7 |
-2.2 |
0.947 |
4 |
0 |
0 |
0.039 |
| 81 |
97 |
|
[PO4]F:1639 |
5 |
1 |
187 |
f |
F |
x,y,z |
1_555 |
6 |
3 |
10407 |
66.4 |
-3.7 |
0.730 |
2 |
0 |
0 |
0.036 |
| 82 |
98 |
|
[PO4]I:1621 |
4 |
1 |
188 |
◊ |
L |
-y-2,x-y-2,z-1/3 |
2_334 |
10 |
4 |
10307 |
66.1 |
-3.8 |
0.780 |
2 |
0 |
0 |
0.000 |
| 83 |
99 |
|
[PO4]D:1629 |
5 |
1 |
190 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
10196 |
65.2 |
-3.7 |
0.740 |
3 |
0 |
0 |
0.047 |
| 84 |
100 |
|
[PO4]K:1610 |
4 |
1 |
188 |
◊ |
K |
x,y,z |
1_555 |
11 |
4 |
10392 |
65.0 |
-4.0 |
0.687 |
2 |
0 |
0 |
0.000 |
| 85 |
101 |
|
[PO4]I:1606 |
5 |
1 |
188 |
f |
L |
-y-2,x-y-2,z-1/3 |
2_334 |
6 |
3 |
10307 |
63.9 |
-1.8 |
0.977 |
3 |
0 |
0 |
0.031 |
| 86 |
102 |
|
[PO4]F:1647 |
5 |
1 |
191 |
f |
F |
x,y,z |
1_555 |
7 |
4 |
10407 |
63.4 |
-3.1 |
0.880 |
2 |
0 |
0 |
0.031 |
| 87 |
103 |
|
[PO4]F:1635 |
4 |
1 |
190 |
◊ |
F |
x,y,z |
1_555 |
7 |
3 |
10407 |
62.4 |
-4.0 |
0.717 |
1 |
0 |
0 |
0.035 |
| 88 |
104 |
|
E |
8 |
3 |
10373 |
◊ |
[PO4]L:1656 |
-y-1,x-y-1,z-1/3 |
2_444 |
4 |
1 |
188 |
61.6 |
-4.0 |
0.520 |
0 |
0 |
0 |
0.000 |
| 89 |
105 |
|
[PO4]A:1615 |
5 |
1 |
190 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
10303 |
61.5 |
-3.5 |
0.825 |
1 |
0 |
0 |
0.000 |
| 90 |
106 |
|
[PO4]J:1613 |
5 |
1 |
189 |
f |
J |
x,y,z |
1_555 |
8 |
5 |
10400 |
61.3 |
-2.8 |
0.879 |
2 |
0 |
0 |
0.033 |
| 91 |
107 |
|
[PO4]K:1608 |
5 |
1 |
189 |
◊ |
K |
x,y,z |
1_555 |
7 |
3 |
10392 |
61.2 |
-2.6 |
0.922 |
3 |
0 |
0 |
0.000 |
| 92 |
108 |
|
A |
9 |
4 |
10303 |
f |
[PO4]F:1611 |
-y-1,x-y-1,z-1/3 |
2_444 |
4 |
1 |
190 |
60.2 |
-4.0 |
0.582 |
2 |
0 |
0 |
0.047 |
| 93 |
109 |
|
[PO4]H:1604 |
5 |
1 |
187 |
f |
I |
-y-1,x-y-1,z-1/3 |
2_444 |
8 |
3 |
10562 |
60.2 |
-3.8 |
0.639 |
1 |
0 |
0 |
0.037 |
| 94 |
110 |
|
[PO4]J:1667 |
4 |
1 |
187 |
f |
J |
x,y,z |
1_555 |
6 |
3 |
10400 |
59.7 |
-3.5 |
0.724 |
1 |
0 |
0 |
0.035 |
| 95 |
111 |
|
[PO4]C:1607 |
5 |
1 |
189 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
10237 |
59.5 |
-2.7 |
0.916 |
1 |
0 |
0 |
0.000 |
| 96 |
112 |
|
[PO4]A:1674 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
10303 |
59.3 |
-3.8 |
0.695 |
1 |
0 |
0 |
0.041 |
| 97 |
113 |
|
[PO4]K:1672 |
4 |
1 |
188 |
f |
K |
x,y,z |
1_555 |
7 |
4 |
10392 |
59.1 |
-3.7 |
0.462 |
1 |
0 |
0 |
0.042 |
| 98 |
114 |
|
[PO4]H:1676 |
5 |
1 |
188 |
f |
H |
x,y,z |
1_555 |
6 |
3 |
10244 |
58.4 |
-2.0 |
0.946 |
2 |
0 |
0 |
0.044 |
| 99 |
115 |
|
J |
5 |
2 |
10400 |
◊ |
K |
-y-2,x-y-2,z-1/3 |
2_334 |
10 |
3 |
10392 |
57.5 |
0.5 |
0.677 |
1 |
0 |
0 |
0.000 |
116 |
|
C |
1 |
1 |
10437 |
◊ |
B |
-y-1,x-y-1,z-1/3 |
2_444 |
3 |
2 |
10237 |
22.2 |
-0.7 |
0.148 |
0 |
0 |
0 |
0.000 |
| Average: |
39.8 |
-0.1 |
0.412 |
1 |
0 |
0 |
0.000 |
| 100 |
117 |
|
[PO4]K:1669 |
5 |
1 |
189 |
◊ |
K |
x,y,z |
1_555 |
6 |
3 |
10392 |
57.2 |
-0.9 |
0.978 |
1 |
0 |
0 |
0.006 |
| 101 |
118 |
|
[PO4]K:1601 |
5 |
1 |
188 |
◊ |
J |
x,y,z |
1_555 |
9 |
4 |
10400 |
56.2 |
-2.9 |
0.835 |
1 |
0 |
0 |
0.014 |
| 102 |
119 |
|
[PO4]A:1626 |
5 |
1 |
189 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
10196 |
56.0 |
-2.8 |
0.841 |
1 |
0 |
0 |
0.004 |
| 103 |
120 |
|
[PO4]L:1643 |
4 |
1 |
189 |
f |
L |
x,y,z |
1_555 |
10 |
3 |
10307 |
54.7 |
-3.2 |
0.769 |
0 |
0 |
0 |
0.032 |
| 104 |
121 |
|
[PO4]B:1638 |
4 |
1 |
188 |
◊ |
J |
x,y,z |
1_555 |
11 |
4 |
10400 |
54.7 |
-2.6 |
0.828 |
1 |
0 |
0 |
0.000 |
| 105 |
122 |
|
[PO4]I:1662 |
4 |
1 |
188 |
f |
I |
x,y,z |
1_555 |
7 |
3 |
10562 |
53.0 |
-1.9 |
0.932 |
1 |
0 |
0 |
0.021 |
| 106 |
123 |
|
G |
9 |
3 |
10469 |
◊ |
[PO4]F:1627 |
-y-1,x-y-2,z-1/3 |
2_434 |
5 |
1 |
190 |
52.9 |
-2.6 |
0.877 |
1 |
0 |
0 |
0.000 |
| 107 |
124 |
|
A |
6 |
2 |
10303 |
◊ |
K |
-y-2,x-y-1,z-1/3 |
2_344 |
7 |
2 |
10392 |
52.4 |
1.0 |
0.785 |
0 |
0 |
0 |
0.000 |
| 108 |
125 |
|
[PO4]D:1629 |
5 |
1 |
190 |
◊ |
A |
-y-1,x-y-1,z-1/3 |
2_444 |
6 |
3 |
10303 |
50.3 |
-1.4 |
0.954 |
1 |
0 |
0 |
0.000 |
| 109 |
126 |
|
[PO4]G:1637 |
4 |
1 |
189 |
f |
G |
x,y,z |
1_555 |
3 |
2 |
10469 |
49.5 |
-1.1 |
0.968 |
2 |
0 |
0 |
0.031 |
| 110 |
127 |
|
[PO4]K:1625 |
4 |
1 |
189 |
f |
K |
x,y,z |
1_555 |
4 |
2 |
10392 |
47.9 |
-1.3 |
0.955 |
3 |
0 |
0 |
0.026 |
| 111 |
128 |
|
[PO4]I:1606 |
4 |
1 |
188 |
◊ |
I |
x,y,z |
1_555 |
5 |
3 |
10562 |
47.6 |
-1.1 |
0.947 |
2 |
0 |
0 |
0.000 |
| 112 |
129 |
|
[PO4]H:1604 |
4 |
1 |
187 |
◊ |
H |
x,y,z |
1_555 |
5 |
2 |
10244 |
47.3 |
-1.6 |
0.939 |
2 |
0 |
0 |
0.000 |
| 113 |
130 |
|
[PO4]H:1676 |
4 |
1 |
188 |
◊ |
F |
x,y,z |
1_555 |
9 |
6 |
10407 |
47.0 |
-2.7 |
0.685 |
0 |
0 |
0 |
0.000 |
| 114 |
131 |
|
[PO4]F:1652 |
4 |
1 |
188 |
◊ |
F |
x,y,z |
1_555 |
4 |
2 |
10407 |
46.4 |
-1.1 |
0.956 |
2 |
0 |
0 |
0.000 |
| 115 |
132 |
|
[PO4]K:1634 |
3 |
1 |
188 |
f |
K |
x,y,z |
1_555 |
3 |
1 |
10392 |
45.6 |
-1.8 |
0.912 |
2 |
0 |
0 |
0.027 |
| 116 |
133 |
|
[PO4]F:1646 |
4 |
1 |
190 |
f |
F |
x,y,z |
1_555 |
4 |
3 |
10407 |
45.6 |
-1.3 |
0.956 |
2 |
0 |
0 |
0.017 |
| 117 |
134 |
|
G |
4 |
2 |
10469 |
f |
[PO4]E:1642 |
-y-1,x-y-2,z-1/3 |
2_434 |
4 |
1 |
187 |
45.0 |
-1.0 |
0.959 |
2 |
0 |
0 |
0.029 |
| 118 |
135 |
|
A |
3 |
2 |
10303 |
◊ |
[PO4]I:1645 |
-y-2,x-y-1,z-1/3 |
2_344 |
3 |
1 |
189 |
45.0 |
-1.3 |
0.924 |
3 |
0 |
0 |
0.000 |
| 119 |
136 |
|
[PO4]C:1623 |
4 |
1 |
187 |
◊ |
B |
-y-1,x-y-1,z-1/3 |
2_444 |
4 |
2 |
10237 |
44.9 |
-1.0 |
0.961 |
2 |
0 |
0 |
0.000 |
| 120 |
137 |
|
[PO4]H:1631 |
5 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
10437 |
44.8 |
-2.4 |
0.722 |
0 |
0 |
0 |
0.000 |
| 121 |
138 |
|
[PO4]C:1648 |
4 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
10437 |
44.2 |
-1.4 |
0.942 |
2 |
0 |
0 |
0.022 |
| 122 |
139 |
|
[PO4]E:1642 |
4 |
1 |
187 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
10373 |
42.9 |
-1.0 |
0.972 |
2 |
0 |
0 |
0.000 |
| 123 |
140 |
|
[PO4]J:1668 |
4 |
1 |
188 |
◊ |
I |
x,y,z |
1_555 |
8 |
3 |
10562 |
42.7 |
-1.6 |
0.890 |
1 |
0 |
0 |
0.018 |
| 124 |
141 |
|
[PO4]A:1664 |
4 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
10303 |
41.8 |
-1.0 |
0.953 |
3 |
0 |
0 |
0.022 |
| 125 |
142 |
|
[PO4]J:1653 |
4 |
1 |
189 |
f |
J |
x,y,z |
1_555 |
5 |
3 |
10400 |
41.7 |
-0.9 |
0.951 |
1 |
0 |
0 |
0.012 |
| 126 |
143 |
|
F |
4 |
1 |
10407 |
◊ |
D |
-y-1,x-y-1,z+2/3 |
2_445 |
4 |
1 |
10196 |
40.9 |
1.0 |
0.855 |
1 |
1 |
0 |
0.000 |
| 127 |
144 |
|
[PO4]I:1665 |
3 |
1 |
188 |
◊ |
F |
x-1,y,z |
1_455 |
5 |
1 |
10407 |
36.9 |
-2.3 |
0.514 |
0 |
0 |
0 |
0.000 |
| 128 |
145 |
|
[PO4]D:1659 |
4 |
1 |
188 |
◊ |
A |
-y-1,x-y-1,z-1/3 |
2_444 |
9 |
6 |
10303 |
36.4 |
-2.0 |
0.742 |
0 |
0 |
0 |
0.000 |
| 129 |
146 |
|
[PO4]H:1604 |
3 |
1 |
187 |
◊ |
F |
-y-1,x-y-2,z-1/3 |
2_434 |
4 |
1 |
10407 |
36.4 |
-1.4 |
0.891 |
3 |
0 |
0 |
0.000 |
| 130 |
147 |
|
[PO4]F:1652 |
4 |
1 |
188 |
f |
H |
x,y,z |
1_555 |
3 |
1 |
10244 |
36.3 |
-2.1 |
0.443 |
0 |
0 |
0 |
0.032 |
| 131 |
148 |
|
[PO4]C:1612 |
3 |
1 |
188 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
10244 |
36.2 |
-0.7 |
0.969 |
1 |
0 |
0 |
0.000 |
| 132 |
149 |
|
[PO4]F:1628 |
3 |
1 |
189 |
◊ |
G |
x,y,z |
1_555 |
2 |
1 |
10469 |
34.1 |
-1.1 |
0.931 |
2 |
0 |
0 |
0.000 |
| 133 |
150 |
|
[PO4]K:1669 |
3 |
1 |
189 |
f |
J |
x,y,z |
1_555 |
5 |
2 |
10400 |
34.1 |
-2.0 |
0.680 |
0 |
0 |
0 |
0.017 |
| 134 |
151 |
|
[PO4]L:1643 |
3 |
1 |
189 |
◊ |
K |
x,y,z |
1_555 |
6 |
2 |
10392 |
33.6 |
-2.1 |
0.659 |
0 |
0 |
0 |
0.021 |
| 135 |
152 |
|
[PO4]F:1605 |
3 |
1 |
189 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
10407 |
33.1 |
-1.0 |
0.930 |
2 |
0 |
0 |
0.000 |
| 136 |
153 |
|
[PO4]F:1652 |
2 |
1 |
188 |
◊ |
E |
x,y,z |
1_555 |
2 |
2 |
10373 |
31.3 |
-1.9 |
0.597 |
0 |
0 |
0 |
0.000 |
| 137 |
154 |
|
C |
5 |
2 |
10437 |
◊ |
E |
-y-1,x-y-2,z-1/3 |
2_434 |
5 |
3 |
10373 |
30.7 |
0.1 |
0.550 |
0 |
0 |
0 |
0.000 |
| 138 |
155 |
|
[PO4]D:1660 |
3 |
1 |
188 |
f |
[PO4]D:1659 |
x,y,z |
1_555 |
4 |
1 |
188 |
29.9 |
-2.8 |
0.982 |
0 |
0 |
0 |
0.026 |
| 139 |
156 |
|
[PO4]J:1613 |
4 |
1 |
189 |
◊ |
E |
x-1,y,z |
1_455 |
4 |
1 |
10373 |
28.6 |
-0.9 |
0.891 |
1 |
0 |
0 |
0.000 |
| 140 |
157 |
|
[PO4]F:1640 |
4 |
1 |
190 |
f |
[PO4]F:1639 |
x,y,z |
1_555 |
3 |
1 |
187 |
28.5 |
-2.8 |
0.982 |
0 |
0 |
0 |
0.022 |
| 141 |
158 |
|
[PO4]D:1659 |
4 |
1 |
188 |
f |
[PO4]D:1629 |
x,y,z |
1_555 |
3 |
1 |
190 |
28.2 |
-2.7 |
0.982 |
0 |
0 |
0 |
0.025 |
| 142 |
159 |
|
[PO4]G:1637 |
3 |
1 |
189 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
10407 |
28.1 |
-1.2 |
0.921 |
1 |
0 |
0 |
0.000 |
| 143 |
160 |
|
[PO4]F:1646 |
4 |
1 |
190 |
◊ |
G |
x,y,z |
1_555 |
3 |
1 |
10469 |
28.0 |
-1.2 |
0.874 |
1 |
0 |
0 |
0.000 |
| 144 |
161 |
|
[PO4]A:1664 |
3 |
1 |
190 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
10196 |
27.9 |
-1.6 |
0.718 |
0 |
0 |
0 |
0.002 |
| 145 |
162 |
|
[PO4]E:1624 |
3 |
1 |
190 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
10244 |
27.6 |
-0.9 |
0.931 |
1 |
0 |
0 |
0.000 |
| 146 |
163 |
|
[PO4]J:1653 |
4 |
1 |
189 |
◊ |
K |
-y-2,x-y-2,z-1/3 |
2_334 |
2 |
1 |
10392 |
27.3 |
-0.4 |
0.980 |
1 |
0 |
0 |
0.000 |
| 147 |
164 |
|
[PO4]I:1655 |
3 |
1 |
188 |
f |
[PO4]I:1621 |
x,y,z |
1_555 |
4 |
1 |
188 |
25.3 |
-2.3 |
0.995 |
0 |
0 |
0 |
0.020 |
| 148 |
165 |
|
A |
4 |
2 |
10303 |
◊ |
[PO4]K:1672 |
-y-2,x-y-1,z-1/3 |
2_344 |
4 |
1 |
188 |
23.2 |
-0.5 |
0.931 |
0 |
0 |
0 |
0.000 |
| 149 |
166 |
|
L |
3 |
1 |
10307 |
◊ |
J |
x,y,z |
1_555 |
4 |
2 |
10400 |
23.0 |
1.3 |
0.909 |
0 |
0 |
0 |
0.000 |
167 |
|
D |
2 |
2 |
10196 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
10237 |
18.2 |
0.7 |
0.834 |
0 |
0 |
0 |
0.000 |
168 |
|
G |
1 |
1 |
10469 |
◊ |
E |
-y-1,x-y-2,z-1/3 |
2_434 |
1 |
1 |
10373 |
9.8 |
0.2 |
0.788 |
0 |
0 |
0 |
0.000 |
| Average: |
17.0 |
0.7 |
0.844 |
0 |
0 |
0 |
0.000 |
| 150 |
169 |
|
[PO4]J:1633 |
3 |
1 |
188 |
◊ |
E |
x-1,y,z |
1_455 |
2 |
1 |
10373 |
22.9 |
-0.7 |
0.956 |
0 |
0 |
0 |
0.000 |
| 151 |
170 |
|
[PO4]C:1623 |
3 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
2 |
1 |
10437 |
20.9 |
-0.5 |
0.961 |
0 |
0 |
0 |
0.005 |
| 152 |
171 |
|
[PO4]F:1640 |
3 |
1 |
190 |
◊ |
[PO4]F:1611 |
x,y,z |
1_555 |
2 |
1 |
190 |
18.9 |
-1.9 |
0.976 |
0 |
0 |
0 |
0.000 |
| 153 |
172 |
|
A |
4 |
2 |
10303 |
◊ |
E |
-y-1,x-y-1,z-1/3 |
2_444 |
4 |
2 |
10373 |
18.2 |
0.5 |
0.786 |
0 |
0 |
0 |
0.000 |
| 154 |
173 |
|
[PO4]G:1637 |
2 |
1 |
189 |
f |
[PO4]F:1605 |
x,y,z |
1_555 |
3 |
1 |
189 |
17.5 |
-1.8 |
0.976 |
0 |
0 |
0 |
0.027 |
| 155 |
174 |
|
[PO4]L:1643 |
3 |
1 |
189 |
◊ |
I |
x,y,z |
1_555 |
2 |
1 |
10562 |
16.9 |
-0.6 |
0.902 |
0 |
0 |
0 |
0.003 |
| 156 |
175 |
|
[PO4]F:1646 |
3 |
1 |
190 |
f |
[PO4]F:1628 |
x,y,z |
1_555 |
3 |
1 |
189 |
16.9 |
-1.7 |
0.992 |
0 |
0 |
0 |
0.014 |
| 157 |
176 |
|
[PO4]F:1628 |
1 |
1 |
189 |
◊ |
[PO4]F:1605 |
x,y,z |
1_555 |
3 |
1 |
189 |
16.9 |
-1.8 |
0.891 |
0 |
0 |
0 |
0.000 |
| 158 |
177 |
|
I |
3 |
1 |
10562 |
◊ |
[PO4]F:1647 |
x-1,y,z |
1_455 |
4 |
1 |
191 |
16.4 |
-0.9 |
0.593 |
0 |
0 |
0 |
0.000 |
| 159 |
178 |
|
[PO4]L:1609 |
3 |
1 |
188 |
f |
[PO4]L:1602 |
x,y,z |
1_555 |
3 |
1 |
187 |
15.4 |
-1.5 |
0.992 |
0 |
0 |
0 |
0.015 |
| 160 |
179 |
|
[PO4]B:1670 |
1 |
1 |
189 |
f |
[PO4]B:1630 |
x,y,z |
1_555 |
2 |
1 |
189 |
14.5 |
-1.5 |
0.876 |
0 |
0 |
0 |
0.015 |
| 161 |
180 |
|
[PO4]F:1646 |
2 |
1 |
190 |
◊ |
[PO4]F:1605 |
x,y,z |
1_555 |
4 |
1 |
189 |
14.1 |
-1.2 |
0.979 |
0 |
0 |
0 |
0.000 |
| 162 |
181 |
|
D |
2 |
1 |
10196 |
◊ |
E |
-y-1,x-y-1,z-1/3 |
2_444 |
3 |
1 |
10373 |
13.2 |
0.3 |
0.767 |
0 |
0 |
0 |
0.000 |
| 163 |
182 |
|
H |
2 |
2 |
10244 |
◊ |
[PO4]J:1633 |
-y-1,x-y-1,z-1/3 |
2_444 |
2 |
1 |
188 |
12.1 |
-0.5 |
0.860 |
0 |
0 |
0 |
0.000 |
| 164 |
183 |
|
[PO4]F:1618 |
2 |
1 |
188 |
◊ |
[PO4]F:1611 |
x,y,z |
1_555 |
1 |
1 |
190 |
11.9 |
-1.2 |
0.876 |
0 |
0 |
0 |
0.000 |
| 165 |
184 |
|
A |
1 |
1 |
10303 |
◊ |
[PO4]F:1640 |
-y-1,x-y-1,z-1/3 |
2_444 |
4 |
1 |
190 |
11.8 |
-0.6 |
0.441 |
0 |
0 |
0 |
0.000 |
| 166 |
185 |
|
[PO4]C:1623 |
2 |
1 |
187 |
◊ |
[PO4]B:1670 |
-y-1,x-y-1,z-1/3 |
2_444 |
2 |
1 |
189 |
11.0 |
-1.2 |
0.960 |
0 |
0 |
0 |
0.000 |
| 167 |
186 |
|
[PO4]H:1676 |
3 |
1 |
188 |
◊ |
G |
x,y,z |
1_555 |
2 |
1 |
10469 |
10.6 |
-0.3 |
0.863 |
0 |
0 |
0 |
0.005 |
| 168 |
187 |
|
[PO4]C:1663 |
3 |
1 |
189 |
◊ |
K |
-y-2,x-y-2,z-1/3 |
2_334 |
2 |
1 |
10392 |
10.4 |
-0.3 |
0.864 |
0 |
0 |
0 |
0.000 |
| 169 |
188 |
|
E |
2 |
2 |
10373 |
◊ |
[PO4]L:1602 |
-y-1,x-y-1,z-1/3 |
2_444 |
2 |
1 |
187 |
9.8 |
-0.5 |
0.753 |
0 |
0 |
0 |
0.000 |
| 170 |
189 |
|
[PO4]F:1675 |
1 |
1 |
188 |
f |
[PO4]F:1646 |
x,y,z |
1_555 |
3 |
1 |
190 |
9.7 |
-0.9 |
0.891 |
0 |
0 |
0 |
0.007 |
| 171 |
190 |
|
A |
1 |
1 |
10303 |
◊ |
[PO4]F:1639 |
-y-1,x-y-1,z-1/3 |
2_444 |
1 |
1 |
187 |
7.9 |
-0.3 |
0.818 |
0 |
0 |
0 |
0.000 |
| 172 |
191 |
|
G |
1 |
1 |
10469 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10237 |
6.8 |
0.5 |
0.903 |
0 |
0 |
0 |
0.000 |
| 173 |
192 |
|
[PO4]K:1661 |
1 |
1 |
187 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
10307 |
6.5 |
-0.3 |
0.764 |
0 |
0 |
0 |
0.003 |
| 174 |
193 |
|
[PO4]J:1603 |
2 |
1 |
189 |
◊ |
I |
x,y,z |
1_555 |
2 |
1 |
10562 |
6.4 |
-0.3 |
0.777 |
0 |
0 |
0 |
0.003 |
| 175 |
194 |
|
[PO4]D:1660 |
1 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
10437 |
6.1 |
-0.2 |
0.794 |
0 |
0 |
0 |
0.002 |
| 176 |
195 |
|
[PO4]F:1636 |
2 |
1 |
189 |
f |
[PO4]F:1628 |
x,y,z |
1_555 |
2 |
1 |
189 |
5.5 |
-0.5 |
0.960 |
0 |
0 |
0 |
0.004 |
| 177 |
196 |
|
[PO4]G:1637 |
2 |
1 |
189 |
◊ |
[PO4]F:1628 |
x,y,z |
1_555 |
2 |
1 |
189 |
5.3 |
-0.4 |
0.960 |
0 |
0 |
0 |
0.000 |
| 178 |
197 |
|
[PO4]F:1650 |
1 |
1 |
187 |
◊ |
K |
x,y,z |
1_555 |
1 |
1 |
10392 |
4.5 |
-0.3 |
0.524 |
0 |
0 |
0 |
0.000 |
| 179 |
198 |
|
B |
1 |
1 |
10237 |
◊ |
[PO4]L:1609 |
-y-2,x-y-1,z-1/3 |
2_344 |
1 |
1 |
188 |
4.2 |
-0.2 |
0.764 |
0 |
0 |
0 |
0.000 |
| 180 |
199 |
|
G |
2 |
1 |
10469 |
◊ |
K |
-y-1,x-y-2,z-1/3 |
2_434 |
1 |
1 |
10392 |
3.9 |
0.2 |
0.767 |
0 |
0 |
0 |
0.000 |
| 181 |
200 |
|
[PO4]L:1643 |
3 |
1 |
189 |
◊ |
[PO4]K:1661 |
x,y,z |
1_555 |
1 |
1 |
187 |
3.3 |
-0.3 |
0.891 |
0 |
0 |
0 |
0.003 |
| 182 |
201 |
|
[PO4]I:1662 |
1 |
1 |
188 |
f |
[PO4]I:1645 |
x,y,z |
1_555 |
1 |
1 |
189 |
3.1 |
-0.3 |
0.800 |
0 |
0 |
0 |
0.003 |
| 183 |
202 |
|
[PO4]K:1634 |
1 |
1 |
188 |
◊ |
[PO4]K:1608 |
x,y,z |
1_555 |
1 |
1 |
189 |
2.8 |
-0.3 |
0.800 |
0 |
0 |
0 |
0.000 |
| 184 |
203 |
|
[PO4]F:1650 |
1 |
1 |
187 |
f |
[PO4]F:1628 |
x,y,z |
1_555 |
1 |
1 |
189 |
2.5 |
-0.3 |
0.800 |
0 |
0 |
0 |
0.002 |
| 185 |
204 |
|
[PO4]L:1602 |
1 |
1 |
187 |
◊ |
I |
x,y,z |
1_555 |
1 |
1 |
10562 |
2.0 |
-0.1 |
0.773 |
0 |
0 |
0 |
0.000 |
| 186 |
205 |
|
[PO4]I:1655 |
1 |
1 |
188 |
◊ |
L |
-y-2,x-y-2,z-1/3 |
2_334 |
1 |
1 |
10307 |
1.9 |
-0.1 |
0.761 |
0 |
0 |
0 |
0.000 |
| 187 |
206 |
|
[PO4]K:1620 |
2 |
1 |
189 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
10307 |
1.2 |
-0.1 |
0.778 |
0 |
0 |
0 |
0.000 |
| 188 |
207 |
|
[PO4]H:1676 |
1 |
1 |
188 |
◊ |
[PO4]F:1646 |
x,y,z |
1_555 |
1 |
1 |
190 |
0.7 |
-0.1 |
0.800 |
0 |
0 |
0 |
0.000 |
| 189 |
208 |
|
[PO4]C:1619 |
1 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
10196 |
0.3 |
-0.0 |
0.695 |
0 |
0 |
0 |
0.000 |
|