| ## |
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 |
|
C |
168 |
44 |
19135 |
◊ |
C |
-x,y,-z+1 |
2_556 |
167 |
44 |
19135 |
1409.8 |
-14.7 |
0.100 |
2 |
4 |
0 |
0.043 |
2 |
|
B |
177 |
44 |
19158 |
◊ |
A |
-x,y,-z+1 |
2_556 |
179 |
45 |
19013 |
1393.3 |
-9.9 |
0.266 |
8 |
1 |
0 |
0.043 |
| Average: |
1401.6 |
-12.3 |
0.183 |
5 |
3 |
0 |
0.043 |
| 2 |
3 |
|
B |
84 |
28 |
19158 |
◊ |
A |
x,y,z |
1_555 |
86 |
24 |
19013 |
819.4 |
-8.7 |
0.124 |
7 |
0 |
0 |
0.048 |
4 |
|
C |
78 |
25 |
19135 |
◊ |
A |
x,y,z |
1_555 |
73 |
25 |
19013 |
723.5 |
-5.9 |
0.237 |
7 |
0 |
0 |
0.048 |
5 |
|
C |
73 |
27 |
19135 |
◊ |
B |
x,y,z |
1_555 |
81 |
23 |
19158 |
695.1 |
-9.4 |
0.083 |
4 |
0 |
0 |
0.048 |
| Average: |
746.0 |
-8.0 |
0.148 |
6 |
0 |
0 |
0.048 |
| 3 |
6 |
|
A |
64 |
18 |
19013 |
◊ |
A |
-x,y,-z |
2_555 |
63 |
18 |
19013 |
571.0 |
1.0 |
0.725 |
6 |
0 |
0 |
0.001 |
| 4 |
7 |
|
A |
25 |
9 |
19013 |
◊ |
A |
-x,y,-z+1 |
2_556 |
25 |
9 |
19013 |
281.0 |
-0.9 |
0.491 |
0 |
0 |
0 |
0.003 |
8 |
|
C |
15 |
7 |
19135 |
◊ |
B |
-x,y,-z+1 |
2_556 |
18 |
7 |
19158 |
155.9 |
-1.6 |
0.306 |
0 |
0 |
0 |
0.003 |
| Average: |
218.5 |
-1.2 |
0.398 |
0 |
0 |
0 |
0.003 |
| 5 |
9 |
|
B |
35 |
12 |
19158 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
32 |
12 |
19135 |
275.6 |
1.8 |
0.804 |
1 |
0 |
0 |
0.000 |
| 6 |
10 |
|
C |
23 |
6 |
19135 |
◊ |
A |
-x,y,-z |
2_555 |
28 |
8 |
19013 |
221.2 |
0.4 |
0.662 |
2 |
2 |
0 |
0.002 |
| 7 |
11 |
|
B |
21 |
8 |
19158 |
◊ |
A |
-x,y,-z |
2_555 |
28 |
10 |
19013 |
204.2 |
1.9 |
0.759 |
2 |
0 |
0 |
0.000 |
| 8 |
12 |
|
B |
19 |
9 |
19158 |
◊ |
B |
-x,y,-z+1 |
2_556 |
19 |
9 |
19158 |
163.8 |
3.2 |
0.902 |
2 |
2 |
0 |
0.000 |
13 |
|
C |
15 |
5 |
19135 |
◊ |
A |
-x,y,-z+1 |
2_556 |
12 |
4 |
19013 |
95.7 |
2.5 |
0.885 |
0 |
0 |
0 |
0.000 |
| Average: |
129.8 |
2.8 |
0.893 |
1 |
1 |
0 |
0.000 |
| 9 |
14 |
|
[NA]A:510 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
19013 |
66.6 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.046 |
| 10 |
15 |
|
[NA]C:512 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
3 |
19135 |
66.2 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.048 |
| 11 |
16 |
|
[NA]A:509 |
1 |
1 |
125 |
f |
A |
-x,y,-z |
2_555 |
10 |
4 |
19013 |
61.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.032 |
| 12 |
17 |
|
[NA]A:513 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
19013 |
57.9 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.028 |
| 13 |
18 |
|
[ZN]A:505 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
19013 |
56.8 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.176 |
19 |
|
[ZN]B:517 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
19158 |
37.7 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.176 |
20 |
|
[ZN]B:504 |
1 |
1 |
98 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
6 |
3 |
19135 |
37.1 |
-19.9 |
0.000 |
0 |
0 |
0 |
0.176 |
21 |
|
[ZN]B:505 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
19158 |
35.6 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.176 |
22 |
|
[ZN]B:517 |
1 |
1 |
98 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
9 |
5 |
19135 |
35.0 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.176 |
23 |
|
[ZN]A:507 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
19013 |
33.6 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.176 |
24 |
|
[ZN]B:504 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
19158 |
29.9 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.176 |
25 |
|
[ZN]B:505 |
1 |
1 |
98 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
6 |
3 |
19135 |
29.5 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.176 |
| Average: |
36.9 |
-16.8 |
0.000 |
0 |
0 |
0 |
0.176 |
| 14 |
26 |
|
[ZN]B:518 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
19158 |
54.9 |
-31.9 |
0.000 |
0 |
0 |
0 |
0.062 |
| 15 |
27 |
|
[ZN]A:504 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
19013 |
53.2 |
-31.1 |
0.000 |
0 |
0 |
0 |
0.114 |
| 16 |
28 |
|
[ZN]A:503 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
19013 |
50.9 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.093 |
| 17 |
29 |
|
[ZN]C:504 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
19135 |
50.5 |
-28.1 |
0.000 |
0 |
0 |
0 |
0.149 |
30 |
|
[ZN]B:510 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
19158 |
49.0 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.149 |
31 |
|
[ZN]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
19013 |
45.2 |
-24.0 |
0.000 |
0 |
0 |
0 |
0.149 |
| Average: |
48.2 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.149 |
| 18 |
32 |
|
[ZN]B:516 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
19158 |
48.9 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.122 |
33 |
|
[ZN]C:509 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
19135 |
43.6 |
-23.0 |
0.000 |
0 |
0 |
0 |
0.122 |
34 |
|
[ZN]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
19013 |
42.9 |
-22.3 |
0.000 |
0 |
0 |
0 |
0.122 |
| Average: |
45.1 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.122 |
| 19 |
35 |
|
[NA]A:512 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
19013 |
46.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.020 |
| 20 |
36 |
|
[ZN]C:507 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
19135 |
46.5 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.120 |
37 |
|
[ZN]B:506 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
19158 |
35.5 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.120 |
| Average: |
41.0 |
-19.0 |
0.000 |
0 |
0 |
0 |
0.120 |
| 21 |
38 |
|
[NA]A:511 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
19013 |
44.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.018 |
| 22 |
39 |
|
[ZN]B:503 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
19158 |
43.2 |
-23.2 |
0.000 |
0 |
0 |
0 |
0.045 |
| 23 |
40 |
|
[ZN]B:509 |
1 |
1 |
98 |
f |
A |
-x,y,-z+1 |
2_556 |
7 |
3 |
19013 |
43.2 |
-22.4 |
0.000 |
0 |
0 |
0 |
0.107 |
41 |
|
[ZN]B:519 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
19158 |
42.0 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.107 |
42 |
|
[ZN]C:506 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
19135 |
38.8 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.107 |
| Average: |
41.3 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.107 |
| 24 |
43 |
|
[ZN]B:515 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
19158 |
42.7 |
-22.7 |
0.000 |
0 |
0 |
0 |
0.044 |
| 25 |
44 |
|
[ZN]A:508 |
1 |
1 |
98 |
f |
B |
-x,y,-z+1 |
2_556 |
8 |
4 |
19158 |
41.5 |
-18.2 |
0.000 |
0 |
0 |
0 |
0.035 |
| 26 |
45 |
|
[ZN]C:505 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
19135 |
41.1 |
-21.9 |
0.000 |
0 |
0 |
0 |
0.116 |
46 |
|
[ZN]B:513 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
19158 |
39.3 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.116 |
| Average: |
40.2 |
-21.1 |
0.000 |
0 |
0 |
0 |
0.116 |
| 27 |
47 |
|
[ZN]C:506 |
1 |
1 |
98 |
◊ |
C |
-x,y,-z+1 |
2_556 |
8 |
3 |
19135 |
40.4 |
-19.7 |
0.000 |
0 |
0 |
0 |
0.104 |
48 |
|
[ZN]B:509 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
19158 |
23.6 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.104 |
49 |
|
[ZN]B:519 |
1 |
1 |
98 |
◊ |
A |
-x,y,-z+1 |
2_556 |
3 |
1 |
19013 |
15.9 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.104 |
| Average: |
26.6 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.104 |
| 28 |
50 |
|
[ZN]B:514 |
1 |
1 |
98 |
f |
A |
-x,y,-z+1 |
2_556 |
13 |
4 |
19013 |
39.7 |
-18.8 |
0.000 |
0 |
0 |
0 |
0.069 |
| 29 |
51 |
|
[ZN]B:512 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
19158 |
37.8 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.070 |
52 |
|
[ZN]B:501 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
19158 |
30.6 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.070 |
53 |
|
[ZN]C:511 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
19135 |
29.4 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.070 |
54 |
|
[ZN]B:501 |
1 |
1 |
98 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
5 |
2 |
19135 |
25.4 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.070 |
| Average: |
30.8 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.070 |
| 30 |
55 |
|
[ZN]B:507 |
1 |
1 |
98 |
◊ |
A |
-x,y,-z |
2_555 |
8 |
3 |
19013 |
36.1 |
-16.7 |
0.000 |
0 |
0 |
0 |
0.055 |
56 |
|
[ZN]B:502 |
1 |
1 |
98 |
◊ |
A |
-x,y,-z |
2_555 |
6 |
4 |
19013 |
27.5 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.055 |
| Average: |
31.8 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.055 |
| 31 |
57 |
|
[ZN]B:514 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
19158 |
34.4 |
-17.0 |
0.000 |
0 |
0 |
0 |
0.032 |
| 32 |
58 |
|
[ZN]C:508 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
19135 |
34.2 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.080 |
| 33 |
59 |
|
[ZN]B:503 |
1 |
1 |
98 |
cf |
A |
-x,y,-z |
2_555 |
5 |
3 |
19013 |
34.1 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.056 |
60 |
|
[ZN]B:508 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
19158 |
31.8 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.056 |
| Average: |
33.0 |
-14.5 |
0.000 |
0 |
0 |
0 |
0.056 |
| 34 |
61 |
|
[NA]A:509 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
19013 |
33.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.004 |
| 35 |
62 |
|
[ZN]C:508 |
1 |
1 |
98 |
◊ |
A |
-x,y,-z |
2_555 |
8 |
2 |
19013 |
32.7 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.038 |
| 36 |
63 |
|
[ZN]C:503 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
19135 |
31.7 |
-14.1 |
0.000 |
0 |
0 |
0 |
0.066 |
64 |
|
B |
7 |
3 |
19158 |
◊ |
[ZN]C:503 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
98 |
29.7 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.066 |
65 |
|
B |
7 |
3 |
19158 |
◊ |
[ZN]C:511 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
98 |
29.5 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.066 |
66 |
|
[ZN]B:512 |
1 |
1 |
98 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
2 |
19135 |
25.1 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.066 |
| Average: |
29.0 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.066 |
| 37 |
67 |
|
[ZN]C:501 |
1 |
1 |
98 |
f |
A |
-x,y,-z |
2_555 |
5 |
3 |
19013 |
31.3 |
-14.3 |
0.000 |
0 |
0 |
0 |
0.053 |
| 38 |
68 |
|
[ZN]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
19158 |
31.2 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.053 |
69 |
|
[ZN]B:507 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
19158 |
31.0 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.053 |
| Average: |
31.1 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.053 |
| 39 |
70 |
|
[ZN]C:510 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
19135 |
30.4 |
-13.4 |
0.000 |
0 |
0 |
0 |
0.071 |
| 40 |
71 |
|
[NA]A:511 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
19135 |
30.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.004 |
| 41 |
72 |
|
[ZN]A:508 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
19013 |
29.9 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.027 |
| 42 |
73 |
|
[ZN]B:511 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
19158 |
29.0 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.025 |
| 43 |
74 |
|
[ZN]A:507 |
1 |
1 |
98 |
f |
[ZN]A:505 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.4 |
-18.8 |
0.000 |
0 |
0 |
0 |
0.100 |
| 44 |
75 |
|
[ZN]B:507 |
1 |
1 |
98 |
f |
[ZN]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.1 |
-17.6 |
0.000 |
0 |
0 |
0 |
0.034 |
| 45 |
76 |
|
[ZN]B:513 |
1 |
1 |
98 |
◊ |
B |
-x,y,-z+1 |
2_556 |
3 |
2 |
19158 |
20.0 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.016 |
77 |
|
[ZN]C:505 |
1 |
1 |
98 |
◊ |
A |
-x,y,-z+1 |
2_556 |
1 |
1 |
19013 |
10.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
15.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.016 |
| 46 |
78 |
|
[ZN]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
3 |
1 |
19135 |
19.8 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.044 |
| 47 |
79 |
|
[NA]A:511 |
1 |
1 |
125 |
◊ |
C |
-x,y,-z+1 |
2_556 |
1 |
1 |
19135 |
17.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.003 |
| 48 |
80 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
[ZN]C:511 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
98 |
15.9 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.021 |
| 49 |
81 |
|
[ZN]B:512 |
1 |
1 |
98 |
f |
[ZN]B:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.5 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.020 |
| 50 |
82 |
|
[ZN]B:512 |
1 |
1 |
98 |
f |
[ZN]C:503 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
98 |
15.3 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.020 |
| 51 |
83 |
|
[ZN]C:511 |
1 |
1 |
98 |
f |
[ZN]C:503 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.9 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.019 |
| 52 |
84 |
|
[ZN]B:517 |
1 |
1 |
98 |
f |
[ZN]B:504 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.5 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.051 |
| 53 |
85 |
|
[ZN]B:513 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
19013 |
14.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.016 |
86 |
|
[ZN]C:505 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
19158 |
13.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
13.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.016 |
| 54 |
87 |
|
[ZN]B:517 |
1 |
1 |
98 |
f |
[ZN]B:505 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.7 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.049 |
| 55 |
88 |
|
[ZN]B:512 |
1 |
1 |
98 |
f |
[ZN]C:511 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
98 |
9.3 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.012 |
| 56 |
89 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
[ZN]C:503 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
98 |
6.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.008 |
| 57 |
90 |
|
[ZN]A:503 |
1 |
1 |
98 |
◊ |
B |
-x,y,-z+1 |
2_556 |
1 |
1 |
19158 |
2.2 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.002 |
| 58 |
91 |
|
[ZN]A:506 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
19013 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|