PUBCHEM-ZINC04517237 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.7930 2.7220 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.2310 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 0.4520 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -1.0390 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -1.8180 -0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4860 -1.4090 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -3.2690 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -4.1200 0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -1.7020 1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -1.8500 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 -1.9900 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0230 -2.1360 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6370 -2.1430 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -2.0050 2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -1.8640 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -1.7230 3.7870 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6060 -2.2490 3.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -1.0800 4.7280 O 0 5 0 0 0 0 0 0 0 0 0 0 -9.1060 -2.2990 1.5860 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.7730 -2.4210 0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6480 -2.3060 2.6770 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1450 3.2770 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 3.0720 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 2.8810 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 1.0720 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 0.8810 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 0.6110 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 0.8020 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -1.1980 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -1.3890 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -1.5230 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 -1.9830 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6160 -2.2440 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3650 -2.0110 3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -3.6170 -1.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -4.5600 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 21 -1 M END