ATOM 20
1 N1y N 24.3417 -18.6016
2 C1y C 24.3417 -17.1980
3 C2y C 25.6750 -19.0225
4 C5x C 22.9383 -18.6016
5 C1y C 22.9383 -17.1980
6 C1x C 25.6750 -16.7770
7 C2y C 26.5172 -17.8998
8 C6a C 26.0960 -20.3558
9 O5x O 21.9559 -19.5840
10 C1b C 21.7453 -16.4963
11 S2a S 27.9207 -17.8998
12 O6a O 27.4996 -20.6366
13 O6a O 25.1839 -21.4085
14 C1b C 29.1135 -17.1980
15 C1b C 30.3066 -17.8998
16 N1b N 31.5697 -17.1980
17 C1a C 20.5524 -17.1980
18 C5a C 32.8004 -17.9355
19 C1a C 34.0116 -17.2620
20 O5a O 32.8477 -19.3315
BOND 21
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 5 10 1 #Down
10 7 11 1
11 8 12 1
12 8 13 2
13 11 14 1
14 14 15 1
15 15 16 1
16 4 5 1
17 6 7 1
18 10 17 1
19 16 18 1
20 18 19 1
21 18 20 2
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