PUBCHEM-ZINC05979931 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 1.2480 2.6630 -1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 1.1780 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 0.3990 -2.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -0.9390 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.4410 -1.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -1.7860 -3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -2.1530 -4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -2.9340 -5.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -3.2500 -4.6640 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -2.3140 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -2.1160 -2.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 -2.6800 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9030 -3.3640 -2.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 -2.4680 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -1.1730 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 -0.9820 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4960 -2.0720 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -3.3580 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5710 -3.5630 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -4.9390 -0.4440 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7930 -5.8900 0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 -5.1220 -1.4210 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5140 -1.7090 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -1.1390 -6.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.7280 -7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.8800 -6.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -1.4450 -5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -1.8650 -4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -0.4280 -7.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.8270 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 2.9730 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 3.2470 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 0.8680 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 1.0140 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -3.3180 -6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 -1.5710 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 -0.3220 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 0.0190 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0270 -1.9170 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 -4.2030 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -1.0200 -7.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -0.2860 -8.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -1.5600 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -2.3100 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.2500 -7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -0.1200 -6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 0.4130 -7.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END