OTAVA-ZINC04226609 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 1.0220 1.7820 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 0.3110 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.2090 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -1.5810 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -2.4100 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -3.8200 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -4.6010 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -3.9870 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -2.5930 -2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -1.7890 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -0.4580 -1.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -1.9870 -3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -1.4910 -4.4740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3070 -2.1310 2.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -1.8020 3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -2.1650 4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -1.8370 5.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -1.1300 6.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -0.7680 5.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -1.0910 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -0.8110 7.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -1.2030 8.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -0.0750 8.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 2.1140 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 2.0210 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 2.3370 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 0.4530 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -4.3350 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -5.6800 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -4.5840 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -2.8940 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -2.7050 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -2.1550 6.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -0.2220 5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -0.8000 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -2.2930 8.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.8790 9.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -0.7490 8.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 0.9110 7.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 0.0980 9.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -0.6320 7.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -2.0940 -4.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 14 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 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 42 2 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 13 -1 M END