PUBCHEM-ZINC05996365 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 0 0 0 0 0 0999 V2000 0.1460 0.7980 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 3.0350 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 3.6470 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 2.9800 3.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 3.3980 4.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 2.7350 5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 3.0630 7.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 4.0630 7.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 4.7240 6.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 4.3940 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 4.4410 8.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 5.7610 9.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 6.9030 9.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 8.1250 9.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 8.2270 10.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 7.0920 10.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 5.8670 9.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 9.4800 10.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 9.6510 10.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 11.1250 11.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 12.9560 12.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -0.2610 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 0.9800 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 1.1470 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 3.4180 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 3.1990 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 4.7190 2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 3.4910 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 1.9590 5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 2.5320 8.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 5.5090 6.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 4.9380 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 4.4650 8.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 3.6590 9.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 6.8540 8.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 9.0030 9.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 7.1170 10.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 4.9930 9.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 9.0320 11.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 9.3930 10.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 11.3310 11.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 11.7580 10.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 13.0990 13.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 13.4960 11.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 13.2620 12.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 1.5470 1.2500 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6820 1.3310 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 1.2190 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 11.5050 12.2640 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2270 11.1850 11.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 10.9750 13.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 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 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 49 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 49 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 M CHG 1 46 1 M CHG 1 49 1 M END