ATOM 18
1 C1z C 18.3521 -29.7728
2 C8y C 17.1657 -30.4707
3 C5x C 19.7479 -29.7728
4 C1x C 17.6542 -28.5863
5 N1b N 19.0500 -30.9592
6 C8x C 15.9094 -29.7728
7 C8x C 17.1657 -31.8665
8 C1x C 20.4459 -28.5165
9 O5x O 20.4459 -30.9592
10 C1x C 18.3521 -27.3301
11 C1b C 18.3521 -32.2155
12 C8y C 14.7230 -30.4707
13 C8x C 15.9094 -32.5644
14 C1x C 19.7479 -27.3301
15 C8x C 14.7230 -31.8665
16 O2a O 13.5106 -29.7707
17 C1a C 12.2981 -30.4707
18 C1a C 19.0521 -33.4279
BOND 19
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 2
6 2 7 1
7 3 8 1
8 3 9 2
9 4 10 1
10 5 11 1
11 6 12 1
12 7 13 2
13 8 14 1
14 12 15 2
15 10 14 1
16 13 15 1
17 12 16 1
18 16 17 1
19 11 18 1
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