Source: Brenda (C. Rea)^Converter: smi2mol (Daylight 4.6) SMI2MOL c1cnc2c(c1)ccc3cccnc32 14 16 0 0 0 0 1 V2000 2.5250 2.4400 0.0000 C 0 0 0 0 0 0 2.0250 1.5700 0.0000 C 0 0 0 0 0 0 1.0150 1.5700 0.0000 N 0 0 0 0 0 0 0.5150 2.4500 0.0000 C 0 0 0 0 0 0 0.9950 3.3100 0.0000 C 0 0 0 0 0 0 2.0150 3.3100 0.0000 C 0 0 0 0 0 0 0.4850 4.1800 0.0000 C 0 0 0 0 0 0 -0.5150 4.1800 0.0000 C 0 0 0 0 0 0 -1.0150 3.3000 0.0000 C 0 0 0 0 0 0 -2.0050 3.3000 0.0000 C 0 0 0 0 0 0 -2.5250 2.4200 0.0000 C 0 0 0 0 0 0 -2.0250 1.5400 0.0000 C 0 0 0 0 0 0 -1.0150 1.5300 0.0000 N 0 0 0 0 0 0 -0.5050 2.4100 0.0000 C 0 0 0 0 0 0 1 6 1 0 1 2 2 0 2 3 1 0 3 4 2 0 4 14 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 14 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 M END