1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24
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Mrv0541 02181205152D
9 9 0 0 0 0 999 V2000
0.2663 -0.7508 0.0000 B 0 5 0 0 0 0 0 0 0 0 0 0
0.9931 -0.3214 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
-0.4509 -0.3430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4509 0.4965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9931 0.4797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2663 0.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2663 -1.5735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7127 -0.7004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2663 1.7271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 1 2 0 0 0 0
3 1 1 0 0 0 0
4 3 2 0 0 0 0
5 2 1 0 0 0 0
6 5 2 0 0 0 0
7 1 1 0 0 0 0
8 2 1 0 0 0 0
9 6 1 0 0 0 0
6 4 1 0 0 0 0
M CHG 2 1 -1 2 1
M END
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