ATOM 24
1 C1a C 16.5900 -20.0900
2 C1b C 17.8024 -19.3900
3 C1b C 19.0149 -20.0900
4 C1b C 20.2273 -19.3900
5 C1b C 21.4397 -20.0900
6 C1b C 22.6522 -19.3900
7 C1c C 23.8646 -20.0900
8 C1b C 25.0770 -19.3900
9 C1b C 26.2895 -20.0900
10 C1b C 27.5019 -19.3900
11 C1b C 28.7144 -20.0900
12 C1b C 29.9268 -19.3900
13 C1b C 31.1392 -20.0900
14 C1b C 32.3517 -19.3900
15 C1b C 33.5641 -20.0900
16 C1b C 34.7765 -19.3900
17 C1b C 35.9890 -20.0900
18 C7a C 37.2014 -19.3900
19 O7a O 38.4138 -20.0900
20 O1a O 23.8646 -21.4900
21 O6a O 37.2014 -17.9904
22 C1b C 39.6383 -19.3829
23 C1b C 40.8400 -20.0768
24 O1a O 42.4442 -19.3930
BOND 23
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 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 7 20 1
20 18 21 2
21 19 22 1
22 22 23 1
23 23 24 1
BRACKET 1 38.0100 -21.0700 38.0100 -18.9000
1 41.2300 -18.9000 41.2300 -21.0700
1 n
ORIGINAL 1 19 22 23
REPEAT 1
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