Mrv1652309112218432D 15 15 0 0 0 0 999 V2000 0.7458 -0.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4537 0.7299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5799 0.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7292 -0.3858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1012 -0.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3239 -0.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1746 0.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9891 0.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3972 0.4434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2479 1.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 1.7897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7148 2.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 3.2712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0696 2.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6533 1.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 11 15 2 0 0 0 0 2 15 1 0 0 0 0 M END > NP0317089 > NP-MRD > CC(C)C1=C/C(/C)=C/CC\C=C(C)\CC\1 > InChI=1S/C15H24/c1-12(2)15-10-9-13(3)7-5-6-8-14(4)11-15/h7-8,11-12H,5-6,9-10H2,1-4H3/b13-7+,14-8+,15-11+ > QHXWKDFSZKIWAT-NSPSWCSISA-N > C15H24 > 204.357 > 204.187800773 > 0 > 39 > 25.608343776966308 > 1 > 0 > 0 > 1 > (1E,3E,7E)-3,8-dimethyl-1-(propan-2-yl)cyclodeca-1,3,7-triene > 4.821593256333333 > 0 > 1 > 0 > 0.0 > 71.3554 > 1 > 1 > (1E,3E,7E)-1-isopropyl-3,8-dimethylcyclodeca-1,3,7-triene > 1 > NP0317089 > (1e,3e,7e)-1-isopropyl-3,8-dimethylcyclodeca-1,3,7-triene $$$$