sample3 CDK 0222181619 8 8 0 0 0 0 0 0 0 0999 V2000 -2.5333 1.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2343 0.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8324 0.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2343 -1.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0647 1.1167 0.0000 R# 0 0 0 0 0 0 0 0 0 0 0 0 -3.8324 -1.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5333 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3638 0.3667 0.0000 R# 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 3 1 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 6 3 2 0 0 0 0 4 7 2 0 0 0 0 7 6 1 0 0 0 0 5 8 1 0 0 0 0 M RGP 2 5 1 8 2 M END