ChEBI Marvin 01301216432D 28 30 0 0 1 0 999 V2000 24.6290 -5.2605 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 24.6290 -4.4355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9145 -4.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9578 -4.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3704 -5.6497 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.9145 -5.6730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6037 -3.6374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7787 -3.6374 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.3984 -6.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2000 -4.4355 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.2000 -5.2605 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.2000 -6.0855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1954 -4.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1954 -5.6497 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 21.1954 -6.4747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.9145 -6.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2000 -3.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3704 -4.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9579 -3.5063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3224 -4.5228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6079 -4.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3224 -5.3478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3435 -5.6730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.3435 -6.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.0580 -6.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6290 -6.9105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9579 -6.3641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5652 -2.8405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6 1 1 0 0 0 0 6 11 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 10 1 0 0 0 0 13 18 2 0 0 0 0 21 13 1 0 0 0 0 21 14 1 0 0 0 0 18 4 1 0 0 0 0 4 5 1 0 0 0 0 5 14 1 0 0 0 0 10 7 1 0 0 0 0 11 10 1 0 0 0 0 7 8 1 0 0 0 0 8 13 1 0 0 0 0 14 9 1 0 0 0 0 11 9 1 0 0 0 0 11 12 1 6 0 0 0 14 15 1 1 0 0 0 10 17 1 1 0 0 0 6 16 2 0 0 0 0 18 19 1 1 0 0 0 21 20 1 0 0 0 0 21 22 1 0 0 0 0 1 23 1 6 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 5 27 1 1 0 0 0 8 28 1 1 0 0 0 M END