ChEBI Mrv1652304232017292D 28 32 0 0 1 0 999 V2000 5.2531 -4.5563 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5385 -4.1439 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5385 -3.3284 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2531 -2.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0935 -2.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8081 -3.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8081 -4.1439 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6432 -4.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5437 -4.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9587 -3.3284 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0935 -4.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9587 -4.1439 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3788 -3.3284 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6734 -4.5563 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3788 -4.1439 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9587 -5.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 -4.5239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2557 -5.2527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6756 -5.3972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4051 -5.8157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9485 -5.8197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1400 -5.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3861 -2.5457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9606 -2.5216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0315 -3.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6081 -3.8031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7501 -2.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5227 -4.5565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13 10 1 0 0 0 0 12 10 1 0 0 0 0 1 12 1 0 0 0 0 14 12 1 0 0 0 0 12 16 1 1 0 0 0 3 4 1 0 0 0 0 2 1 1 0 0 0 0 2 3 1 0 0 0 0 5 13 1 0 0 0 0 15 13 1 0 0 0 0 15 14 1 0 0 0 0 15 11 1 0 0 0 0 15 9 1 1 0 0 0 6 5 1 0 0 0 0 7 6 1 0 0 0 0 7 11 1 0 0 0 0 7 8 1 1 0 0 0 8 9 1 0 0 0 0 2 17 1 1 0 0 0 1 18 1 0 0 0 0 20 19 2 0 0 0 0 21 19 1 0 0 0 0 14 19 1 1 0 0 0 22 8 2 0 0 0 0 13 23 1 1 0 0 0 10 24 1 6 0 0 0 1 25 1 6 0 0 0 26 25 2 0 0 0 0 25 24 1 0 0 0 0 4 10 1 0 0 0 0 3 27 1 1 0 0 0 7 28 1 6 0 0 0 M END