| ## |
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 |
|
I |
158 |
37 |
10403 |
◊ |
H |
x,y,z |
1_555 |
155 |
37 |
10201 |
1424.1 |
-12.8 |
0.349 |
6 |
5 |
0 |
0.171 |
2 |
|
E |
150 |
36 |
10523 |
◊ |
D |
x,y,z |
1_555 |
150 |
36 |
10425 |
1363.3 |
-14.9 |
0.210 |
7 |
3 |
0 |
0.171 |
3 |
|
G |
149 |
36 |
10297 |
◊ |
F |
x,y,z |
1_555 |
152 |
36 |
10465 |
1354.1 |
-16.9 |
0.222 |
6 |
4 |
0 |
0.171 |
4 |
|
C |
145 |
35 |
10252 |
◊ |
B |
x,y,z |
1_555 |
146 |
36 |
10184 |
1342.3 |
-18.5 |
0.129 |
6 |
4 |
0 |
0.171 |
5 |
|
A |
145 |
35 |
10298 |
◊ |
A |
y,x,-z+2 |
4_557 |
146 |
35 |
10298 |
1330.9 |
-15.9 |
0.217 |
3 |
2 |
0 |
0.171 |
| Average: |
1362.9 |
-15.8 |
0.226 |
6 |
4 |
0 |
0.171 |
| 2 |
6 |
|
H |
75 |
16 |
10201 |
◊ |
F |
x,y,z |
1_555 |
73 |
24 |
10465 |
678.8 |
-9.0 |
0.217 |
0 |
1 |
0 |
0.074 |
7 |
|
C |
69 |
23 |
10252 |
◊ |
A |
y,x,-z+2 |
4_557 |
76 |
17 |
10298 |
666.1 |
-9.0 |
0.150 |
1 |
0 |
0 |
0.074 |
8 |
|
E |
70 |
23 |
10523 |
◊ |
C |
x,y,z |
1_555 |
74 |
18 |
10252 |
653.3 |
-8.4 |
0.152 |
0 |
0 |
0 |
0.074 |
9 |
|
F |
73 |
16 |
10465 |
◊ |
D |
x,y,z |
1_555 |
71 |
23 |
10425 |
651.1 |
-8.3 |
0.204 |
1 |
0 |
0 |
0.074 |
10 |
|
B |
72 |
17 |
10184 |
◊ |
A |
x,y,z |
1_555 |
68 |
21 |
10298 |
642.0 |
-10.0 |
0.132 |
1 |
1 |
0 |
0.074 |
11 |
|
D |
77 |
18 |
10425 |
◊ |
B |
x,y,z |
1_555 |
69 |
22 |
10184 |
639.4 |
-8.7 |
0.176 |
0 |
0 |
0 |
0.074 |
12 |
|
I |
64 |
21 |
10403 |
◊ |
G |
x,y,z |
1_555 |
73 |
17 |
10297 |
638.8 |
-8.6 |
0.146 |
1 |
1 |
0 |
0.074 |
13 |
|
G |
67 |
21 |
10297 |
◊ |
E |
x,y,z |
1_555 |
71 |
17 |
10523 |
633.0 |
-8.0 |
0.191 |
1 |
1 |
0 |
0.074 |
| Average: |
650.3 |
-8.7 |
0.171 |
1 |
1 |
0 |
0.074 |
| 3 |
14 |
|
F |
59 |
20 |
10465 |
◊ |
D |
-y+1,x-y+1,z |
2_665 |
55 |
17 |
10425 |
584.5 |
-4.7 |
0.444 |
0 |
2 |
0 |
0.000 |
| 4 |
15 |
|
F |
49 |
15 |
10465 |
◊ |
E |
-y+1,x-y+1,z |
2_665 |
63 |
18 |
10523 |
534.5 |
-6.0 |
0.310 |
0 |
0 |
0 |
0.000 |
| 5 |
16 |
|
H |
61 |
15 |
10201 |
◊ |
A |
-y+1,x-y+1,z-1 |
2_664 |
51 |
19 |
10298 |
517.6 |
-4.7 |
0.441 |
0 |
0 |
0 |
0.000 |
| 6 |
17 |
|
E |
23 |
8 |
10523 |
◊ |
C |
y,x,-z+1 |
4_556 |
23 |
9 |
10252 |
219.6 |
2.2 |
0.786 |
2 |
4 |
0 |
0.000 |
| 7 |
18 |
|
H |
16 |
6 |
10201 |
◊ |
G |
x,y,z |
1_555 |
15 |
6 |
10297 |
115.5 |
-1.5 |
0.398 |
0 |
0 |
0 |
0.006 |
19 |
|
F |
13 |
5 |
10465 |
◊ |
E |
x,y,z |
1_555 |
13 |
5 |
10523 |
112.1 |
-1.4 |
0.392 |
0 |
0 |
0 |
0.006 |
20 |
|
D |
14 |
5 |
10425 |
◊ |
C |
x,y,z |
1_555 |
14 |
5 |
10252 |
104.8 |
-1.6 |
0.348 |
0 |
0 |
0 |
0.006 |
21 |
|
B |
13 |
5 |
10184 |
◊ |
A |
y,x,-z+2 |
4_557 |
13 |
5 |
10298 |
100.9 |
-1.6 |
0.358 |
0 |
0 |
0 |
0.006 |
| Average: |
108.3 |
-1.6 |
0.374 |
0 |
0 |
0 |
0.006 |
| 8 |
22 |
|
[SO4]E:306 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
17 |
11 |
10523 |
115.1 |
-18.6 |
0.617 |
0 |
0 |
0 |
0.068 |
| 9 |
23 |
|
[SO4]C:305 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
17 |
6 |
10252 |
110.7 |
-17.3 |
0.710 |
1 |
0 |
0 |
0.065 |
| 10 |
24 |
|
C |
12 |
5 |
10252 |
◊ |
C |
y,x,-z+1 |
4_556 |
12 |
5 |
10252 |
104.8 |
-0.6 |
0.572 |
0 |
0 |
0 |
0.000 |
| 11 |
25 |
|
[SO4]D:305 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
17 |
6 |
10425 |
103.7 |
-14.7 |
0.802 |
1 |
0 |
0 |
0.055 |
| 12 |
26 |
|
[SO4]G:302 |
5 |
1 |
185 |
f |
G |
x,y,z |
1_555 |
17 |
6 |
10297 |
100.4 |
-16.0 |
0.777 |
2 |
0 |
0 |
0.096 |
| 13 |
27 |
|
[SO4]A:303 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
10298 |
96.8 |
-12.7 |
0.959 |
3 |
0 |
0 |
0.146 |
| 14 |
28 |
|
[SO4]E:303 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
14 |
6 |
10523 |
96.2 |
-12.9 |
0.958 |
2 |
0 |
0 |
0.050 |
| 15 |
29 |
|
[SO4]B:304 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
10184 |
95.3 |
-12.4 |
0.962 |
2 |
0 |
0 |
0.049 |
| 16 |
30 |
|
[SO4]C:302 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
15 |
6 |
10252 |
95.2 |
-12.7 |
0.960 |
3 |
0 |
0 |
0.052 |
| 17 |
31 |
|
[SO4]D:304 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
10425 |
93.9 |
-12.2 |
0.960 |
3 |
0 |
0 |
0.049 |
| 18 |
32 |
|
[SO4]F:304 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
15 |
6 |
10465 |
92.7 |
-12.3 |
0.962 |
2 |
0 |
0 |
0.076 |
| 19 |
33 |
|
[SO4]C:304 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
10252 |
88.4 |
-11.8 |
0.844 |
1 |
0 |
0 |
0.045 |
| 20 |
34 |
|
[SO4]E:307 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
10523 |
88.2 |
-12.2 |
0.880 |
3 |
0 |
0 |
0.049 |
| 21 |
35 |
|
[SO4]E:302 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
16 |
4 |
10523 |
86.0 |
-11.8 |
0.789 |
3 |
0 |
0 |
0.048 |
| 22 |
36 |
|
[SO4]D:308 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
10425 |
85.4 |
-11.4 |
0.849 |
1 |
0 |
0 |
0.043 |
| 23 |
37 |
|
[SO4]B:306 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
10184 |
84.5 |
-11.9 |
0.865 |
2 |
0 |
0 |
0.047 |
| 24 |
38 |
|
[SO4]D:303 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
10425 |
84.5 |
-11.6 |
0.787 |
3 |
0 |
0 |
0.047 |
| 25 |
39 |
|
[SO4]A:302 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
10298 |
84.5 |
-11.9 |
0.802 |
2 |
0 |
0 |
0.133 |
| 26 |
40 |
|
[SO4]G:303 |
4 |
1 |
186 |
f |
G |
x,y,z |
1_555 |
10 |
4 |
10297 |
83.9 |
-11.5 |
0.799 |
0 |
0 |
0 |
0.066 |
| 27 |
41 |
|
[SO4]C:303 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
15 |
5 |
10252 |
83.3 |
-11.7 |
0.718 |
1 |
0 |
0 |
0.045 |
| 28 |
42 |
|
[SO4]B:303 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
10184 |
82.6 |
-12.2 |
0.676 |
1 |
0 |
0 |
0.046 |
| 29 |
43 |
|
[SO4]E:305 |
5 |
1 |
184 |
f |
G |
x,y,z |
1_555 |
10 |
4 |
10297 |
82.5 |
-11.5 |
0.683 |
1 |
0 |
0 |
0.068 |
| 30 |
44 |
|
[SO4]F:303 |
5 |
1 |
182 |
f |
F |
x,y,z |
1_555 |
12 |
5 |
10465 |
82.3 |
-12.2 |
0.699 |
1 |
0 |
0 |
0.072 |
| 31 |
45 |
|
[SO4]D:307 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
10425 |
82.2 |
-11.7 |
0.835 |
3 |
0 |
0 |
0.047 |
| 32 |
46 |
|
[SO4]C:306 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
10252 |
79.7 |
-10.5 |
0.910 |
1 |
0 |
0 |
0.040 |
| 33 |
47 |
|
[SO4]C:307 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
12 |
4 |
10252 |
78.2 |
-10.0 |
0.928 |
2 |
0 |
0 |
0.040 |
| 34 |
48 |
|
[SO4]D:301 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
10184 |
75.8 |
-10.5 |
0.687 |
1 |
0 |
0 |
0.040 |
| 35 |
49 |
|
[SO4]E:304 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
11 |
4 |
10523 |
74.2 |
-10.2 |
0.698 |
1 |
0 |
0 |
0.039 |
| 36 |
50 |
|
[SO4]B:305 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
10184 |
73.1 |
-9.3 |
0.872 |
0 |
0 |
0 |
0.034 |
| 37 |
51 |
|
[SO4]A:304 |
5 |
1 |
186 |
f |
C |
y,x,-z+2 |
4_557 |
11 |
4 |
10252 |
71.8 |
-10.0 |
0.647 |
0 |
0 |
0 |
0.037 |
| 38 |
52 |
|
[SO4]F:301 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
10425 |
71.1 |
-9.7 |
0.627 |
1 |
0 |
0 |
0.037 |
| 39 |
53 |
|
[SO4]A:304 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
10298 |
70.9 |
-9.0 |
0.922 |
2 |
0 |
0 |
0.010 |
| 40 |
54 |
|
[SO4]D:301 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
10425 |
70.1 |
-8.6 |
0.940 |
2 |
0 |
0 |
0.010 |
| 41 |
55 |
|
[SO4]B:301 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
10298 |
70.1 |
-9.6 |
0.672 |
1 |
0 |
0 |
0.105 |
| 42 |
56 |
|
[SO4]B:301 |
5 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
9 |
2 |
10184 |
70.0 |
-8.3 |
0.951 |
2 |
0 |
0 |
0.009 |
| 43 |
57 |
|
[SO4]F:301 |
4 |
1 |
184 |
◊ |
F |
x,y,z |
1_555 |
7 |
2 |
10465 |
69.3 |
-8.4 |
0.945 |
2 |
0 |
0 |
0.010 |
| 44 |
58 |
|
[SO4]E:304 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
10252 |
65.6 |
-7.9 |
0.936 |
2 |
0 |
0 |
0.009 |
| 45 |
59 |
|
[SO4]E:305 |
5 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
10523 |
60.6 |
-7.0 |
0.938 |
2 |
0 |
0 |
0.008 |
| 46 |
60 |
|
[SO4]D:306 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
10425 |
57.5 |
-8.0 |
0.704 |
1 |
0 |
0 |
0.031 |
| 47 |
61 |
|
[ZN]H:500 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
6 |
5 |
10201 |
51.5 |
-40.0 |
0.000 |
0 |
0 |
0 |
0.829 |
62 |
|
[ZN]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
6 |
10252 |
51.4 |
-39.8 |
0.000 |
0 |
0 |
0 |
0.829 |
63 |
|
[ZN]G:301 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
7 |
6 |
10297 |
51.4 |
-38.9 |
0.000 |
0 |
0 |
0 |
0.829 |
64 |
|
[ZN]E:301 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
7 |
6 |
10523 |
51.2 |
-39.9 |
0.000 |
0 |
0 |
0 |
0.829 |
65 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
10298 |
51.2 |
-40.0 |
0.000 |
0 |
0 |
0 |
0.829 |
66 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
10184 |
50.9 |
-38.9 |
0.000 |
0 |
0 |
0 |
0.829 |
67 |
|
[ZN]F:302 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
5 |
4 |
10465 |
50.9 |
-39.0 |
0.000 |
0 |
0 |
0 |
0.829 |
68 |
|
[ZN]I:500 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
7 |
6 |
10403 |
50.6 |
-38.9 |
0.000 |
0 |
0 |
0 |
0.829 |
69 |
|
[ZN]D:302 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
5 |
10425 |
50.5 |
-38.8 |
0.000 |
0 |
0 |
0 |
0.829 |
| Average: |
51.1 |
-39.4 |
0.000 |
0 |
0 |
0 |
0.829 |
| 48 |
70 |
|
[SO4]B:303 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
10298 |
48.9 |
-5.5 |
0.823 |
0 |
0 |
0 |
0.006 |
| 49 |
71 |
|
[SO4]A:302 |
5 |
1 |
185 |
◊ |
C |
y,x,-z+2 |
4_557 |
5 |
2 |
10252 |
45.7 |
-5.1 |
0.839 |
0 |
0 |
0 |
0.010 |
72 |
|
[SO4]D:303 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
10184 |
40.5 |
-5.1 |
0.830 |
0 |
0 |
0 |
0.010 |
| Average: |
43.1 |
-5.1 |
0.834 |
0 |
0 |
0 |
0.010 |
| 50 |
73 |
|
[SO4]F:303 |
5 |
1 |
182 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
10425 |
44.8 |
-4.8 |
0.804 |
0 |
0 |
0 |
0.005 |
| 51 |
74 |
|
[SO4]E:307 |
4 |
1 |
185 |
◊ |
C |
y,x,-z+1 |
4_556 |
7 |
4 |
10252 |
44.0 |
-4.5 |
0.843 |
0 |
0 |
0 |
0.000 |
| 52 |
75 |
|
[SO4]C:303 |
5 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
10523 |
41.8 |
-5.1 |
0.794 |
0 |
0 |
0 |
0.005 |
| 53 |
76 |
|
[SO4]C:303 |
4 |
1 |
186 |
f |
[SO4]C:302 |
x,y,z |
1_555 |
4 |
1 |
185 |
41.6 |
-9.4 |
0.998 |
0 |
0 |
0 |
0.034 |
| 54 |
77 |
|
[SO4]D:304 |
4 |
1 |
184 |
f |
[SO4]D:303 |
x,y,z |
1_555 |
4 |
1 |
185 |
40.4 |
-9.1 |
0.998 |
0 |
0 |
0 |
0.033 |
| 55 |
78 |
|
[SO4]E:302 |
4 |
1 |
186 |
◊ |
G |
x,y,z |
1_555 |
5 |
2 |
10297 |
40.2 |
-5.0 |
0.825 |
1 |
0 |
0 |
0.006 |
| 56 |
79 |
|
[SO4]E:303 |
4 |
1 |
185 |
f |
[SO4]E:302 |
x,y,z |
1_555 |
4 |
1 |
186 |
40.0 |
-9.0 |
0.998 |
0 |
0 |
0 |
0.033 |
| 57 |
80 |
|
[SO4]A:303 |
4 |
1 |
185 |
f |
[SO4]A:302 |
x,y,z |
1_555 |
4 |
1 |
185 |
38.2 |
-8.6 |
0.998 |
0 |
0 |
0 |
0.089 |
| 58 |
81 |
|
[SO4]F:304 |
4 |
1 |
186 |
f |
[SO4]F:303 |
x,y,z |
1_555 |
4 |
1 |
182 |
37.8 |
-8.5 |
0.998 |
0 |
0 |
0 |
0.048 |
| 59 |
82 |
|
[SO4]B:304 |
4 |
1 |
185 |
f |
[SO4]B:303 |
x,y,z |
1_555 |
4 |
1 |
186 |
35.7 |
-7.9 |
0.998 |
0 |
0 |
0 |
0.029 |
| 60 |
83 |
|
I |
4 |
2 |
10403 |
◊ |
A |
-y+1,x-y+1,z-1 |
2_664 |
3 |
1 |
10298 |
35.1 |
0.5 |
0.789 |
0 |
0 |
0 |
0.000 |
| 61 |
84 |
|
[SO4]E:307 |
3 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
10252 |
32.8 |
-3.9 |
0.548 |
1 |
0 |
0 |
0.004 |
| 62 |
85 |
|
I |
3 |
2 |
10403 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
10465 |
26.3 |
0.7 |
0.887 |
0 |
0 |
0 |
0.000 |
86 |
|
E |
2 |
1 |
10523 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
10184 |
22.1 |
0.6 |
0.878 |
0 |
0 |
0 |
0.000 |
87 |
|
C |
1 |
1 |
10252 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
10298 |
20.8 |
0.5 |
0.884 |
0 |
0 |
0 |
0.000 |
88 |
|
G |
1 |
1 |
10297 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
10425 |
18.2 |
0.4 |
0.894 |
0 |
0 |
0 |
0.000 |
| Average: |
21.8 |
0.5 |
0.886 |
0 |
0 |
0 |
0.000 |
| 63 |
89 |
|
[SO4]B:301 |
1 |
1 |
185 |
◊ |
A |
y,x,-z+2 |
4_557 |
1 |
1 |
10298 |
22.6 |
-1.8 |
0.888 |
0 |
0 |
0 |
0.019 |
| 64 |
90 |
|
[SO4]E:304 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
10425 |
20.8 |
-1.7 |
0.878 |
0 |
0 |
0 |
0.006 |
| 65 |
91 |
|
[SO4]E:305 |
1 |
1 |
184 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
10465 |
16.1 |
-2.2 |
0.347 |
0 |
0 |
0 |
0.013 |
| 66 |
92 |
|
[SO4]F:301 |
1 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
10523 |
14.5 |
-2.0 |
0.359 |
0 |
0 |
0 |
0.007 |
| 67 |
93 |
|
[SO4]A:304 |
1 |
1 |
186 |
◊ |
B |
y,x,-z+2 |
4_557 |
1 |
1 |
10184 |
14.5 |
-2.0 |
0.357 |
0 |
0 |
0 |
0.007 |
| 68 |
94 |
|
[SO4]D:301 |
1 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
10252 |
13.6 |
-1.9 |
0.488 |
0 |
0 |
0 |
0.007 |
| 69 |
95 |
|
[SO4]C:306 |
1 |
1 |
185 |
f |
[SO4]C:304 |
x,y,z |
1_555 |
1 |
1 |
184 |
7.9 |
-1.9 |
0.800 |
0 |
0 |
0 |
0.007 |
| 70 |
96 |
|
[SO4]C:307 |
1 |
1 |
185 |
f |
[SO4]C:304 |
x,y,z |
1_555 |
1 |
1 |
184 |
7.6 |
-1.8 |
0.800 |
0 |
0 |
0 |
0.007 |
| 71 |
97 |
|
[SO4]D:305 |
1 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
10523 |
2.6 |
-0.3 |
0.871 |
0 |
0 |
0 |
0.001 |
| 72 |
98 |
|
[SO4]D:305 |
1 |
1 |
184 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
10465 |
1.8 |
-0.2 |
0.678 |
0 |
0 |
0 |
0.000 |
| 73 |
99 |
|
[SO4]C:307 |
1 |
1 |
185 |
◊ |
A |
y,x,-z+2 |
4_557 |
1 |
1 |
10298 |
1.5 |
-0.1 |
0.898 |
0 |
0 |
0 |
0.000 |
|