ATOM 21
1 C8y C 28.1019 -18.6085
2 C8x C 29.4273 -18.6085
3 C8y C 30.0862 -17.4599
4 C8y C 29.4273 -16.3111
5 C8x C 28.1019 -16.3111
6 C8x C 27.4358 -17.4599
7 O7a O 26.0771 -19.7089
8 C7a C 27.4119 -19.7388
9 O6a O 28.0570 -20.9069
10 C1y C 25.3707 -18.4733
11 C1x C 24.3652 -16.9466
12 C1x C 24.3652 -17.9939
13 C1y C 22.8969 -16.9466
14 C1y C 22.8140 -17.9939
15 N1y N 22.0466 -16.0228
16 C1x C 21.8552 -17.5612
17 C1x C 21.3175 -18.6704
18 C1a C 22.0394 -14.5763
19 O1a O 30.0829 -15.1614
20 O2a O 31.4010 -17.4594
21 C1a C 32.1337 -16.1705
BOND 23
1 5 6 1
2 6 1 2
3 1 2 1
4 2 3 2
5 7 8 1
6 10 11 1
7 10 12 1
8 11 13 1
9 12 14 1
10 13 15 1
11 13 16 1
12 14 17 1
13 14 15 1
14 16 17 1
15 10 7 1 #Down
16 8 1 1
17 15 18 1
18 8 9 2
19 4 19 1
20 3 4 1
21 3 20 1
22 4 5 2
23 20 21 1
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