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accholine.mol
29 lines (27 loc) · 865 Bytes
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accholine.mol
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ACETYLCHOLINE & stuff
GTMACCS-II11299515322D 1 0.00377 0.00000 0 GST
10 9 0 0 0 0 2 V2000
2.5762 -0.3621 0.0000 N 0 3 3 0 0 0
1.2862 -1.2032 0.0000 C 0 0 0 0 0 0
3.8700 -1.2032 0.0000 C 0 0 0 0 0 0
2.5762 1.3051 0.0000 C 0 0 0 0 0 0
3.8700 0.4715 0.0000 C 0 0 0 0 0 0
0.0000 -0.3621 0.0000 C 0 0 0 0 0 0
-1.2862 -1.2032 0.0000 O 0 0 0 0 0 0
-2.5762 -0.3621 0.0000 C 0 0 0 0 0 0
-3.8700 -1.2032 0.0000 C 0 0 0 0 0 0
-2.5762 1.3051 0.0000 O 0 0 0 0 0 0
1 2 1 0 0 0
1 3 1 0 0 0
1 4 1 0 0 0
1 5 1 0 0 0
2 6 1 0 0 0
6 7 1 0 0 0
7 8 1 0 0 0
8 9 1 0 0 0
8 10 2 0 0 0
M CHG 1 1 1
M END
> <REGNO>
ACCHOLINE
$$$$