1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34
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$RXN
ISIS 082120061354
2 1
$MOL
-ISIS- 08210613542D
3 2 0 0 0 0 0 0 0 0999 V2000
-1.4340 -0.6042 0.0000 C 0 0 0 0 0 0 0 0 0 2 0 0
-0.8639 -0.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4340 0.0542 0.0000 O 0 0 0 0 0 0 0 0 0 1 0 0
1 2 1 0 0 0 0
1 3 2 0 0 0 0
M END
$MOL
-ISIS- 08210613542D
1 0 0 0 0 0 0 0 0 0999 V2000
2.2125 -0.7833 0.0000 N 0 0 0 0 0 0 0 0 0 3 0 0
M END
$MOL
-ISIS- 08210613542D
3 2 0 0 0 0 0 0 0 0999 V2000
9.5282 -0.8083 0.0000 N 0 0 0 0 0 0 0 0 0 3 0 0
8.9579 -0.4792 0.0000 C 0 0 0 0 0 0 0 0 0 2 0 0
8.9579 0.1792 0.0000 O 0 0 0 0 0 0 0 0 0 1 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
M END
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