ATOM 28
1 C1c C 18.0516 -22.0218
2 C5a C 16.8345 -22.7266
3 N1b N 18.0516 -20.6242
4 C1b C 19.2573 -22.7266
5 N1b N 15.6232 -22.0218
6 O5a O 16.8345 -24.1301
7 C5a C 16.8345 -19.9253
8 S2a S 20.4687 -22.0218
9 R R 14.4118 -22.7266
10 O5a O 16.8345 -18.5275
11 R R 15.6232 -20.6242
12 C5a C 21.6717 -22.6939
13 C1b C 22.8849 -21.9935
14 C1b C 24.0980 -22.6939
15 C1b C 25.3112 -21.9935
16 C1b C 26.5244 -22.6939
17 C1b C 27.7376 -21.9935
18 C1b C 28.9507 -22.6939
19 C1b C 30.1639 -21.9935
20 C1b C 31.3771 -22.6939
21 C1b C 32.5903 -21.9935
22 C1b C 33.8035 -22.6939
23 C1b C 35.0167 -21.9935
24 C1b C 36.2299 -22.6939
25 C1b C 37.4431 -21.9935
26 C1b C 38.6562 -22.6939
27 C1a C 39.8694 -21.9935
28 O5a O 21.6717 -24.0948
BOND 27
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 1
8 5 9 1
9 7 10 2
10 7 11 1
11 8 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 22 23 1
23 23 24 1
24 24 25 1
25 25 26 1
26 26 27 1
27 12 28 2
|