Mrv1652309042200102D 14 15 0 0 1 0 999 V2000 -0.5837 -1.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1712 -0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5837 0.0165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6538 -0.6979 0.0000 C 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 2 0 0 0 0 0 0 0 0 0 1.8371 0.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 0.1271 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6378 0.9521 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 2 0 0 0 0 0 0 0 0 0 1.1387 -1.3654 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 2 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 1 0 0 0 6 8 1 0 0 0 0 8 9 1 1 0 0 0 8 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 6 13 1 0 0 0 0 13 14 1 6 0 0 0 4 14 1 0 0 0 0 M END > NP0183290 > NP-MRD > C[C@H]1CCC[C@@H]2CC(=C[C@]12C)C(C)=O > InChI=1S/C13H20O/c1-9-5-4-6-12-7-11(10(2)14)8-13(9,12)3/h8-9,12H,4-7H2,1-3H3/t9-,12+,13+/m0/s1 > WKNLFMXMEHMEGH-ZWKOPEQDSA-N > C13H20O > 192.302 > 192.151415264 > 1 > 34 > 23.129195019466557 > 1 > 0 > 0 > 1 > 1-[(3aR,4S,7aR)-3a,4-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-inden-2-yl]ethan-1-one > 3.212116898 > 0 > 2 > 0 > 19.67925113664575 > -4.910128144630242 > 17.07 > 59.1926 > 1 > 1 > 1-[(3aR,4S,7aR)-3a,4-dimethyl-1,4,5,6,7,7a-hexahydroinden-2-yl]ethanone > 1 > NP0183290 > 1-[(3ar,4s,7ar)-3a,4-dimethyl-1,4,5,6,7,7a-hexahydroinden-2-yl]ethanone $$$$