ATOM 18
1 C1x C 22.4428 -16.6848
2 C1x C 22.4428 -18.0801
3 C1x C 23.6541 -18.7778
4 C1x C 23.6541 -15.9871
5 C1y C 24.8583 -16.6848
6 N1y N 24.8524 -18.0801
7 C5x C 26.0578 -18.7828
8 C1y C 27.2691 -18.0904
9 C1x C 27.2750 -16.6951
10 C1y C 26.0696 -15.9922
11 C1x C 27.2701 -15.2823
12 N1y N 28.4821 -15.9660
13 C1y C 28.4681 -17.3824
14 C1x C 29.6877 -18.1028
15 C1x C 30.9215 -17.4068
16 C1x C 30.9355 -15.9903
17 C1x C 29.7159 -15.2698
18 O5x O 26.0439 -20.1731
BOND 21
1 10 9 1 #Up
2 10 5 1
3 10 11 1
4 8 13 1
5 11 12 1
6 1 2 1
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 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 12 1
19 7 8 1
20 8 9 1 #Up
21 7 18 2
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