1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22
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Bad number of bonds
csChFnd70/05230312262D
7 8 0 0 0 0 0 0 0 0999 V2000
1.2124 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4249 0.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6373 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4249 2.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 0.7000 0.0000 Y 0 0 0 0 0 0 0 0 0 0 0 0
4.8477 0.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0581 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
2 4 2 0 0 0 0
1 5 1 0 0 0 0
3 6 1 0 0 0 0
6 7 1 0 0 0 0
M END
> <ID> (6)
Lig4
$$$$
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