3013853 -OEChem-03282404492D 16 17 0 0 0 0 0 0 0999 V2000 5.2619 -0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 1.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -1.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 2 6 1 0 0 0 0 3 5 2 0 0 0 0 3 7 1 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 6 8 2 0 0 0 0 6 12 1 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 16 1 0 0 0 0 M END > 3013853 > 1 > 88.7 > 0 > 1 > 0 > AAADcYByAAAAAAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAFgB8AAAHAAQAAAADADBGgQ8gNLJkACgAjBnRACCgCAxACAI2aAoRJgIIOLAkZGEIAhggADIyAcQgIAOgAAAAAAQAAAAAAAAACAAAAAAAAAAAA== > 2H-isoindole > 2H-isoindole > 2H-isoindole > 2H-isoindole > 2H-isoindole > 2H-isoindole > InChI=1S/C8H7N/c1-2-4-8-6-9-5-7(8)3-1/h1-6,9H > VHMICKWLTGFITH-UHFFFAOYSA-N > 2 > 117.057849228 > C8H7N > 117.15 > C1=CC2=CNC=C2C=C1 > C1=CC2=CNC=C2C=C1 > 15.8 > 117.057849228 > 0 > 9 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 4 8 1 5 8 2 3 8 2 4 8 2 6 8 3 5 8 3 7 8 6 8 8 7 9 8 8 9 8 $$$$