Mrv1652309052216182D 14 15 0 0 1 0 999 V2000 0.8838 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1387 -1.3654 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6538 -0.6979 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1712 -0.6979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1387 -0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 0.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1075 0.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1681 0.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -1.1104 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8371 -1.9309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 3 4 1 6 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 6 13 1 0 0 0 0 2 13 1 0 0 0 0 13 14 1 6 0 0 0 M END > NP0214882 > NP-MRD > C[C@@H]1[C@H](O)C=C2[C@@]1(C)C=CCC2(C)C > InChI=1S/C13H20O/c1-9-10(14)8-11-12(2,3)6-5-7-13(9,11)4/h5,7-10,14H,6H2,1-4H3/t9-,10-,13+/m1/s1 > MHUYBIUXLMLCJM-BREBYQMCSA-N > C13H20O > 192.302 > 192.151415264 > 1 > 34 > 22.833779848050217 > 1 > 1 > 0 > 1 > (1S,2R,7aS)-1,4,4,7a-tetramethyl-2,4,5,7a-tetrahydro-1H-inden-2-ol > 2.476066902666667 > 0 > 2 > 0 > 18.441599012649647 > -1.2934445918670434 > 20.23 > 60.9545 > 0 > 1 > (1S,2R,7aS)-1,4,4,7a-tetramethyl-2,5-dihydro-1H-inden-2-ol > 1 > NP0214882 > (1s,2r,7as)-1,4,4,7a-tetramethyl-2,5-dihydro-1h-inden-2-ol $$$$