IBS-ZINC02295735 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 0 0 0 0 0999 V2000 -1.3360 1.6250 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 0.3120 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 0.2600 0.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -0.7570 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -2.0850 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -3.0270 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -4.4720 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -5.3230 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -6.7050 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -7.2560 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -6.4110 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -5.0260 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -8.6200 -0.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -9.2160 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -2.4970 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -2.5520 -0.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.8320 1.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -3.3230 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -4.0660 3.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -4.5980 4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -4.3750 3.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 2.4520 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 1.7160 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 1.6820 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -0.5470 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -2.7460 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -4.9220 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -7.3570 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -6.7910 -2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -4.3870 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -9.0690 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -8.8390 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -10.2920 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -2.7150 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -3.9670 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -2.4520 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -3.4060 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -4.9130 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -5.2060 5.3500 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 M CHG 1 39 -1 M END