ATOM 24
1 C1y C 29.2797 -22.0500
2 C1y C 29.2797 -20.6500
3 O2x O 30.4922 -22.7500
4 C1y C 31.7046 -22.0500
5 C1y C 31.7046 -20.6500
6 C1y C 30.4922 -19.9500
7 O1a O 30.4922 -18.5503
8 O1a O 32.9211 -19.9477
9 O1a O 36.0011 -22.8223
10 C6a C 28.0526 -22.7586
11 O6a O 26.8496 -21.8541
12 O6a O 28.0528 -24.1499
13 C2y C 20.4400 -20.6500
14 C2x C 20.4400 -22.0500
15 C1y C 21.6524 -22.7500
16 C1y C 22.8649 -22.0500
17 C1y C 22.8649 -20.6500
18 O2x O 21.6524 -19.9500
19 C6a C 19.2276 -19.9500
20 O1a O 21.6524 -24.1498
21 O6a O 18.0321 -20.6404
22 O6a O 19.2275 -18.5502
23 O1a O 24.0960 -22.9710
24 O2a O 27.5073 -20.0900
BOND 25
1 1 2 1
2 1 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 2 6 1
7 6 7 1 #Down
8 5 8 1 #Down
9 4 9 1 #Down
10 1 10 1 #Either
11 10 11 1
12 10 12 2
13 13 14 2
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 13 18 1
19 13 19 1
20 15 20 1 #Up
21 19 21 2
22 19 22 1
23 16 23 1 #Up
24 17 24 1 #Up
25 2 24 1 #Up
BRACKET 1 25.9000 -23.1700 25.9000 -19.0400
1 34.2300 -19.7400 34.2300 -23.8700
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 10 11 12 24
REPEAT 1
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