PUBCHEM-ZINC05985940 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 1.5130 1.4850 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 0.8950 1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 2.8230 0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 3.2090 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 4.5450 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 5.0750 -0.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 5.0450 -0.7310 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2630 5.5850 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 5.8500 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 6.2750 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7830 5.9850 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 6.7560 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2520 6.4210 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0620 5.3880 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7290 4.6690 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6160 4.9270 -1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 7.0150 -3.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 6.1440 -2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 6.6540 -3.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 5.6700 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 5.8140 -2.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 3.6320 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 2.7060 -1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 1.4170 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 1.0400 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 1.9550 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 3.2370 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8460 1.5590 1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 0.4800 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 2.2130 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 1.7450 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 1.5580 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -0.1010 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 0.8180 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 3.5480 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 2.7380 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 3.2850 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 2.4260 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 4.4540 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 5.2850 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5010 7.5980 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5510 6.9910 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3990 3.8480 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3970 4.3020 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7270 7.2300 -3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 2.9780 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 0.7090 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 0.0430 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 3.9380 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1940 2.3450 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 1.4700 0.6230 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1380 0.8280 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 51 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END