ATOM 18
1 X I 34.1887 -19.6115 #-
2 N1d N 30.0854 -19.6318 #+
3 C1a C 30.1015 -20.9882
4 C1a C 30.0675 -18.1821
5 C1a C 31.5352 -19.5915
6 C8y C 28.7290 -19.5788
7 C8y C 25.9330 -19.5698
8 C8x C 26.6281 -20.7827
9 C8x C 28.0261 -20.7873
10 C8x C 28.0340 -18.3657
11 C8x C 26.6357 -18.3613
12 N1y N 24.5339 -19.5764
13 C5x C 23.7118 -18.4449
14 C2x C 22.3811 -18.8794
15 C2x C 22.3857 -20.2795
16 C5x C 23.7191 -20.7054
17 O5x O 24.1447 -17.1089
18 O5x O 24.1585 -22.0395
BOND 18
1 8 9 1
2 9 6 2
3 6 10 1
4 10 11 2
5 11 7 1
6 13 14 1
7 2 6 1
8 2 4 1
9 2 5 1
10 12 13 1
11 14 15 2
12 15 16 1
13 16 12 1
14 12 7 1
15 2 3 1
16 13 17 2
17 7 8 2
18 16 18 2
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