10 10 0 0000 0 0 0 0 0999 V2000 4.6539 -4.6073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.9884 -3.4578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6539 -2.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.9884 -1.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.6574 -1.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.9965 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1.9965 -2.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.6655 -2.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.0000 -3.4578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.6574 -3.4578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 10 2 0 3 4 2 0 4 5 1 0 5 6 1 0 5 7 2 0 7 8 1 0 7 10 1 0 8 9 2 0 M END > InChI=1S/C7H6O3/c8-4-5-3-6(9)1-2-7(5)10/h1-4,9-10H > CLFRCXCBWIQVRN-UHFFFAOYSA-N > 1/0/N:3,4,10,8,7,2,5,9,1,6/rA:10nOCCCCOCCOC/rB:s1;s2;d3;s4;s5;d5;s7;d8;d2s7;/rC:4.6539,-4.6073,0;3.9884,-3.4578,0;4.6539,-2.3037,0;3.9884,-1.1542,0;2.6574,-1.1542,0;1.9965,0,0;1.9965,-2.3037,0;.6655,-2.3037,0;0,-3.4578,0;2.6574,-3.4578,0; > C7 H6 O3 > 138.1207 > OC1=CC(C=O)=C(O)C=C1 > 64111 $$$$