PUBCHEM-ZINC06224936 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 3.4710 0.4650 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 0.0320 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -1.2150 -1.8880 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0160 -2.3740 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -3.6000 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -3.6030 -2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -2.3640 -3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -1.1650 -2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 0.0660 -3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 0.0900 -4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -1.0890 -5.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.3020 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4140 -5.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -2.3830 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -1.9270 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -1.6090 1.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.1600 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -0.7800 3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.3510 4.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.2850 5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -0.6550 4.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.0860 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -1.6320 2.5570 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 0.0120 4.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -1.7390 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -3.1940 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -0.2690 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 0.5370 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 1.4370 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -0.1260 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 0.8080 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -4.5320 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -4.5310 -3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 0.9890 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -1.0420 -6.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -3.2090 -5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.6860 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 1.3320 -5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 2.1800 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -2.7510 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -0.8250 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 0.0530 6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -0.6070 5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -0.7150 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -1.0980 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -1.4390 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -3.8460 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -3.4570 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -3.3160 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M CHG 1 3 1 M END