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6lu7cov_valproic_acid_0
OpenBabel03022010313D
11 11 0 0 0 0 0 0 0 0999 V2000
-35.1260 14.0100 54.2980 C 0 0 0 0 0
-35.7440 14.5480 54.2110 C 0 0 0 0 0
-36.5230 14.3020 54.3270 C 0 0 0 0 0
-34.3460 14.2560 54.1810 C 0 0 0 0 0
-34.1860 15.0390 53.9790 C 0 0 0 0 0
-34.8060 15.5770 53.8920 C 0 0 0 0 0
-34.6470 16.3620 53.6890 C 0 0 0 0 0
-33.8870 12.9340 54.4710 O 0 0 0 0 0
-33.7270 13.7170 54.2680 C 0 0 0 0 0
-32.9480 13.9630 54.1520 O 0 0 0 0 0
-32.7660 14.8530 53.9220 H 0 0 0 0 0
4 1 1 0 0 0
2 1 2 0 0 0
6 2 1 0 0 0
2 3 1 0 0 0
5 4 2 0 0 0
4 9 1 0 0 0
6 5 1 0 0 0
7 6 2 0 0 0
9 8 2 0 0 0
10 9 1 0 0 0
11 10 1 0 0 0
M RAD 4 1 2 3 4 5 2 7 3
M END
> <Vina Binding Affinity>
-6.3
$$$$
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