ATOM 13
1 C1b C 11.1300 -20.2300
2 C6a C 12.3900 -19.5300
3 O6a O 13.5800 -20.2300
4 O6a O 12.3900 -18.1300
5 C5a C 9.9400 -19.5300
6 C8y C 8.7500 -20.2300
7 O5a O 9.9400 -18.1300
8 C8y C 8.7500 -21.6300
9 C8x C 7.5600 -19.5300
10 C8x C 7.5600 -22.3300
11 C8x C 6.3000 -20.2300
12 C8x C 6.3000 -21.6300
13 N1a N 9.9653 -22.3251
BOND 13
1 1 2 1
2 2 3 1
3 2 4 2
4 5 6 1
5 5 7 2
6 6 8 2
7 6 9 1
8 8 10 1
9 9 11 2
10 10 12 2
11 11 12 1
12 5 1 1
13 8 13 1
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