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aspirin 2D deprotonated
-ISIS- 2D
Used JOELib chemistry kernel (expert systems) ID is 715333816
13 13 0 0 0 0 0 0 0 0 1 V2000
13.6802 -4.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.7420 -3.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.8037 -4.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.8037 -5.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.7420 -6.0702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.6802 -5.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.8655 -3.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.8655 -6.0702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
16.8655 -7.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.8037 -7.9093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
17.9273 -7.9093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
17.9273 -4.2312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
16.8655 -2.3922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 1 2 0 0 0 0
3 2 1 0 0 0 0
4 3 2 0 0 0 0
5 4 1 0 0 0 0
6 5 2 0 0 0 0
6 1 1 0 0 0 0
7 3 1 0 0 0 0
8 4 1 0 0 0 0
9 8 1 0 0 0 0
10 9 2 0 0 0 0
11 9 1 0 0 0 0
12 7 1 0 0 0 0
13 7 2 0 0 0 0
M END
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