ATOM 19
1 C1y C 23.0713 -16.6827
2 C1x C 23.0713 -18.0778
3 C5x C 24.2825 -18.7754
4 C1x C 24.2825 -15.9851
5 C1y C 25.4866 -16.6827
6 N1y N 25.4807 -18.0778
7 C1x C 26.6859 -18.7805
8 C1y C 27.8971 -18.0881
9 C1x C 27.9030 -16.6930
10 C1y C 26.6977 -15.9901
11 C1x C 27.8981 -15.2804
12 O5x O 24.2691 -20.1706
13 N1y N 29.1100 -15.9639
14 C1y C 29.0959 -17.3802
15 C1x C 30.3154 -18.1005
16 C1x C 31.5491 -17.4046
17 C1x C 31.5631 -15.9883
18 C1x C 30.3436 -15.2679
19 O1a O 21.8593 -15.9851
BOND 22
1 10 5 1
2 10 11 1
3 8 14 1
4 11 13 1
5 1 2 1
6 3 12 2
7 2 3 1
8 3 6 1
9 5 4 1
10 4 1 1
11 5 6 1
12 6 7 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 13 1
19 7 8 1
20 8 9 1 #Up
21 1 19 1 #Up
22 10 9 1 #Up
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