8 8 0 0000 0 0 0 0 0999 V2000 2.8660 1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 8 1 0 2 3 2 0 2 4 1 0 3 5 1 0 4 6 2 0 5 7 2 0 6 7 1 0 M END > 2 3 8 2 4 8 3 5 8 4 6 8 5 7 8 6 7 8 > InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3/i2+2 > RDOXTESZEPMUJZ-HQMMCQRPSA-N > 1/0/N:8,7,5,6,3,4,2,1/E:(3,4)(5,6)/I:/E:m/rA:16nOCCCCCC.i14CHHHHHHHH/rB:s1;d2;s2;s3;d4;d5s6;s1;s3;s4;s5;s6;s7;s8;s8;s8;/rC:2.866,1.56,0;2.866,.56,0;3.7321,.06,0;2,.06,0;3.7321,-.94,0;2,-.94,0;2.866,-1.44,0;3.7321,2.06,0;4.269,.37,0;1.4631,.37,0;4.269,-1.25,0;1.4631,-1.25,0;2.866,-2.06,0;4.0421,1.5231,0;4.269,2.37,0;3.4221,2.5969,0; > C7 H8 O > 110.1304 > O(C([H])([H])[H])C1C([H])=C([H])[14C]([H])=C([H])C=1[H] > 9106624 $$$$