PUBCHEM-ZINC05501911 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 0.2390 -0.6090 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -0.0550 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -2.0960 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -2.5060 1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.1990 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 1.2510 1.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5380 1.8900 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 1.7010 1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 3.1230 1.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 4.1700 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 5.2960 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 4.9450 3.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 3.6460 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 2.8720 4.4200 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9290 1.6560 4.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 3.4520 5.4820 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8070 1.3460 3.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -1.6940 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -0.1820 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -0.3440 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 1.0300 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -0.3200 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.5020 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -2.4850 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -3.5940 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.1170 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -2.1000 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -0.2730 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -0.8390 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 1.1200 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 1.5450 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 4.1060 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 6.3040 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 0.8020 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.6300 1.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 35 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 34 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END