Mrv1652309082215432D 15 17 0 0 1 0 999 V2000 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 4.0668 -1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7812 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4957 -1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4957 -2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7812 -2.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0668 -2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -2.7604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8532 -2.6029 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5983 -3.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3683 -1.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8532 -1.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -1.5229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 3 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 6 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 2 15 1 0 0 0 0 10 15 1 0 0 0 0 M END > NP0268556 > NP-MRD > O[C@@H]1CCN2C1=NC1=CC=CC=C1C2=C > InChI=1S/C12H12N2O/c1-8-9-4-2-3-5-10(9)13-12-11(15)6-7-14(8)12/h2-5,11,15H,1,6-7H2/t11-/m1/s1 > VZMMDLXOQXIQHD-LLVKDONJSA-N > C12H12N2O > 200.241 > 200.094963014 > 3 > 27 > 21.563884491846483 > 1 > 1 > 0 > 1 > (3R)-9-methylidene-1H,2H,3H,9H-pyrrolo[2,1-b]quinazolin-3-ol > 0.8827985320000002 > 0 > 3 > 0 > 13.720249984989728 > 5.40210487229871 > 35.830000000000005 > 61.06410000000001 > 0 > 1 > (3R)-9-methylidene-1H,2H,3H-pyrrolo[2,1-b]quinazolin-3-ol > 1 > NP0268556 > (3r)-9-methylidene-1h,2h,3h-pyrrolo[2,1-b]quinazolin-3-ol $$$$