159989 -OEChem-03282420582D 29 28 0 0 0 0 0 0 0999 V2000 1.8360 7.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9699 6.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 6.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9699 5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 5.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 8.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 8.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 6.8600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2389 6.8600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 5.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2389 5.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 4.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 8.3600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 2.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 1.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2389 8.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 9.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9399 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 7 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 3 5 2 0 0 0 0 3 15 1 0 0 0 0 4 6 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 18 1 0 0 0 0 7 9 2 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 13 2 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 M END > 159989 > 1 > 119 > 0 > 0 > 2 > AAADceBwAAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGAAAAAAADACAGAAyAIAAAACAAiBCAAACAAAgAAAIiAAAAIgIICKAERCAIAAggAAIiAcAgAAOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > isoprene;styrene > 2-methylbuta-1,3-diene;styrene > 2-methylbuta-1,3-diene;styrene > 2-methylbuta-1,3-diene;styrene > ethenylbenzene;2-methylbuta-1,3-diene > isoprene;styrene > InChI=1S/C8H8.C5H8/c1-2-8-6-4-3-5-7-8;1-4-5(2)3/h2-7H,1H2;4H,1-2H2,3H3 > ROGIWVXWXZRRMZ-UHFFFAOYSA-N > 172.125200510 > C13H16 > 172.27 > CC(=C)C=C.C=CC1=CC=CC=C1 > CC(=C)C=C.C=CC1=CC=CC=C1 > 0 > 172.125200510 > 0 > 13 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 1 2 8 1 3 8 2 4 8 3 5 8 4 6 8 5 6 8 $$$$