ChEBI Marvin 05070810322D 29 31 0 0 1 0 999 V2000 16.7406 -8.1137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7406 -7.2748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4397 -6.8554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4397 -8.5332 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.9427 -8.3584 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.9427 -7.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4048 -6.0515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1388 -5.6321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7057 -5.6670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4048 -9.3371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7057 -9.7566 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.7057 -10.5954 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 17.4048 -11.0148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9717 -10.9799 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.9717 -11.8188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2727 -10.5954 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.5386 -10.9799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2727 -9.7566 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.9717 -9.3371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5386 -9.3371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8396 -9.7566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1874 -9.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9408 -6.1263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1388 -7.2748 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.1388 -6.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4320 -7.6942 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 18.1388 -8.1137 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 18.1388 -8.9387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2570 -7.6942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 4 1 1 0 0 0 0 3 2 2 0 0 0 0 24 3 1 0 0 0 0 7 3 1 0 0 0 0 27 24 1 0 0 0 0 27 4 1 0 0 0 0 27 5 1 0 0 0 0 4 10 1 6 0 0 0 5 26 1 0 0 0 0 5 22 1 6 0 0 0 26 6 1 0 0 0 0 24 6 1 0 0 0 0 8 7 2 0 0 0 0 9 7 1 0 0 0 0 23 9 1 0 0 0 0 11 10 1 1 0 0 0 12 11 1 0 0 0 0 19 11 1 0 0 0 0 12 13 1 6 0 0 0 14 12 1 0 0 0 0 14 15 1 1 0 0 0 16 14 1 0 0 0 0 16 17 1 6 0 0 0 18 16 1 0 0 0 0 19 18 1 0 0 0 0 18 20 1 1 0 0 0 21 20 1 0 0 0 0 24 25 1 6 0 0 0 26 29 1 6 0 0 0 27 28 1 6 0 0 0 M END