KEGG:C10723 Tricyclodehydroisohumulone ISISHOST03240423262D 1 1.00000 0.00000 9777 27 29 0 1 0 999 V2000 4.1234 -11.5242 0.0000 C 0 0 0 0 0 0 0 0 0 3.4541 -11.0375 0.0000 C 0 0 1 0 0 0 0 0 0 2.7849 -11.5242 0.0000 C 0 0 3 0 0 0 0 0 0 3.0399 -12.3059 0.0000 C 0 0 1 0 0 0 0 0 0 2.7820 -13.0914 0.0000 C 0 0 0 0 0 0 0 0 0 3.4495 -13.5792 0.0000 C 0 0 0 0 0 0 0 0 0 3.8666 -12.3084 0.0000 C 0 0 1 0 0 0 0 0 0 4.1167 -13.0980 0.0000 C 0 0 1 0 0 0 0 0 0 4.9450 -13.1042 0.0000 C 0 0 0 0 0 0 0 0 0 5.2067 -12.3184 0.0000 C 0 0 0 0 0 0 0 0 0 4.5403 -11.8265 0.0000 C 0 0 0 0 0 0 0 0 0 4.3495 -13.8895 0.0000 O 0 0 0 0 0 0 0 0 0 5.4249 -13.7752 0.0000 O 0 0 0 0 0 0 0 0 0 3.4469 -14.4042 0.0000 O 0 0 0 0 0 0 0 0 0 2.0667 -11.9292 0.0000 C 0 0 0 0 0 0 0 0 0 2.0667 -11.1083 0.0000 C 0 0 0 0 0 0 0 0 0 2.3208 -12.7125 0.0000 H 0 0 0 0 0 0 0 0 0 3.4541 -10.2125 0.0000 C 0 0 0 0 0 0 0 0 0 4.1686 -9.8000 0.0000 C 0 0 0 0 0 0 0 0 0 2.7396 -9.8000 0.0000 C 0 0 0 0 0 0 0 0 0 4.5465 -11.0016 0.0000 O 0 0 0 0 0 0 0 0 0 5.9167 -11.9042 0.0000 C 0 0 0 0 0 0 0 0 0 6.6292 -12.3167 0.0000 C 0 0 0 0 0 0 0 0 0 7.3417 -11.9042 0.0000 C 0 0 3 0 0 0 0 0 0 8.0542 -12.3167 0.0000 C 0 0 0 0 0 0 0 0 0 5.9153 -11.0792 0.0000 O 0 0 0 0 0 0 0 0 0 7.3417 -11.0792 0.0000 C 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 9 13 1 0 0 0 5 6 1 0 0 0 6 14 2 0 0 0 6 8 1 0 0 0 3 15 1 0 0 0 2 3 1 0 0 0 3 16 1 0 0 0 3 4 1 0 0 0 4 17 1 1 0 0 2 18 1 1 0 0 7 1 1 6 0 0 18 19 2 0 0 0 1 2 1 0 0 0 18 20 1 0 0 0 7 8 1 0 0 0 11 21 2 0 0 0 8 9 1 0 0 0 10 22 1 0 0 0 9 10 2 0 0 0 22 23 1 0 0 0 10 11 1 0 0 0 23 24 1 0 0 0 11 7 1 0 0 0 24 25 1 0 0 0 7 4 1 0 0 0 22 26 2 0 0 0 8 12 1 6 0 0 24 27 1 0 0 0 M END