ChEBI Marvin 02181016462D 29 30 0 0 1 0 999 V2000 15.0078 -9.7902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0078 -8.9638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.7204 -10.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1816 -9.7902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1816 -8.9638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.7204 -8.5508 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.4443 -9.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7128 -11.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5980 -10.3700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3456 -8.4394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4443 -8.9638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1568 -10.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9965 -11.4464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4254 -11.4578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8731 -9.7939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9167 -8.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5857 -10.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2004 -8.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2983 -9.7939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5896 -11.0294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4879 -8.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7753 -8.8423 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0590 -8.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7753 -9.6685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3464 -8.8461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0627 -7.6067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0078 -8.1414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6293 -8.8487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6256 -9.6737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 7 2 0 0 0 0 3 8 1 0 0 0 0 4 9 2 0 0 0 0 5 10 1 1 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 8 14 2 0 0 0 0 12 15 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 1 0 0 0 23 25 1 0 0 0 0 23 26 2 0 0 0 0 4 5 1 0 0 0 0 7 11 1 0 0 0 0 2 27 1 6 0 0 0 16 28 1 0 0 0 0 28 10 1 0 0 0 0 28 29 2 0 0 0 0 M END