ATOM 18
1 N1x N 26.5544 -18.5085
2 C5x C 27.7693 -17.8210
3 C8y C 29.0717 -18.3357
4 C8y C 29.4767 -19.6657
5 C1x C 26.3408 -19.9013
6 C2y C 28.6906 -20.8973
7 C1x C 27.2929 -20.9282
8 C8x C 30.8667 -19.6914
9 C8x C 31.3208 -18.3776
10 N4x N 30.2114 -17.5397
11 O5x O 27.8148 -16.4547
12 C2y C 29.9447 -22.0666
13 C5x C 30.3937 -23.3926
14 N2x N 31.7936 -23.3753
15 C2y C 32.2098 -22.0386
16 N1x N 31.0670 -21.2298
17 O5x O 29.5863 -24.5333
18 N1a N 33.5236 -21.5938
BOND 20
1 3 4 2
2 1 5 1
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 4 8 1
9 8 9 2
10 9 10 1
11 3 10 1
12 2 11 2
13 12 13 1
14 13 14 1
15 14 15 2
16 15 16 1
17 12 16 1
18 6 12 2
19 13 17 2
20 15 18 1
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