IBS-ZINC02350529 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 36 0 0 1 0 0 0 0 0999 V2000 0.4350 1.8580 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 0.4100 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.3300 -1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -1.9450 -1.1440 P 0 0 3 0 0 0 0 0 0 0 0 0 1.9280 -2.4260 0.4910 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -2.4950 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -2.6260 -2.9790 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -4.4260 -2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -4.8530 -3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -4.1660 -3.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -6.1100 -4.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -6.7760 -4.8800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6590 -6.5800 -4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -6.1760 -6.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -6.4710 -7.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -6.6200 -6.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -8.3160 -4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -8.6690 -4.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 1.9450 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 2.2630 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 2.4690 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.0170 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 0.3340 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -2.1380 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -3.5860 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -2.1110 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -4.8510 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -4.8150 -1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -6.6910 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -5.0840 -6.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -7.5400 -7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -5.9520 -8.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -6.1280 -6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -7.6820 -7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -6.4360 -6.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -6.0580 -7.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -9.0220 -5.0210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 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 4 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 M CHG 1 37 -1 M END