ChEBI Marvin 09120512302D 13 13 0 0 0 0 999 V2000 4.1552 -4.5462 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 4.1405 -5.3951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -4.5457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1483 -3.6342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3215 -4.5316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4941 -3.8774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3148 -3.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6451 -3.3348 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9000 -2.5535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2556 -2.0290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5716 -2.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8178 -3.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7903 -2.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 1 1 0 0 0 0 4 1 1 0 0 0 0 5 1 1 0 0 0 0 6 3 1 0 0 0 0 7 6 1 0 0 0 0 12 7 1 0 0 0 0 9 8 1 0 0 0 0 12 8 1 0 0 0 0 10 9 2 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 13 11 1 0 0 0 0 M END