12 12 0 0000 0 0 0 0 0999 V2000 4.2690 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 4 2 0 1 5 1 0 2 3 2 0 2 11 1 0 3 6 1 0 3 7 1 0 4 8 1 0 5 9 2 0 8 10 2 0 9 10 1 0 11 12 3 0 M END > 1 4 8 1 5 8 4 8 8 5 9 8 8 10 8 9 10 8 > InChI=1S/C12H12/c1-4-12(10(2)3)11-8-6-5-7-9-11/h1,5-9H,2-3H3 > KMTOCKMZARAVFR-UHFFFAOYSA-N > 1/0/N:12,6,7,11,10,8,9,4,5,3,1,2/E:(2,3)(6,7)(8,9)/rA:24nCCCCCCCCCCCCHHHHHHHHHHHH/rB:s1;d2;d1;s1;s3;s3;s4;d5;d8s9;s2;t11;s4;s5;s6;s6;s6;s7;s7;s7;s8;s9;s10;s12;/rC:4.269,-.25,0;4.269,.75,0;5.135,1.25,0;5.135,-.75,0;3.403,-.75,0;5.135,2.25,0;6.001,.75,0;5.135,-1.75,0;3.403,-1.75,0;4.269,-2.25,0;3.403,1.25,0;2.5369,1.75,0;5.6719,-.44,0;2.866,-.44,0;4.515,2.25,0;5.135,2.87,0;5.755,2.25,0;6.311,1.2869,0;6.538,.44,0;5.691,.2131,0;5.6719,-2.06,0;2.866,-2.06,0;4.269,-2.87,0;2,2.06,0; > C12 H12 > 156.2237 > C1(C([H])=C([H])C([H])=C([H])C=1[H])/C(/C#C[H])=C(\C([H])([H])[H])/C([H])([H])[H] > 515928 $$$$