OTAVA-ZINC01167462 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -1.6640 -1.7300 -5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -2.4430 -3.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -2.4300 -2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -3.0210 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 -3.0100 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -2.4040 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -1.8110 -1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -1.8210 -3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -2.3910 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -2.9890 1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 -1.6560 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3080 -2.1860 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3020 -1.0980 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5070 -1.2530 0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6750 0.0880 0.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 -0.1600 0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7540 0.1890 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 0.5370 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2420 0.4440 2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 1.0830 3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 1.8150 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 1.9070 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 1.2640 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 2.6900 2.1510 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1200 3.1610 3.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 2.8640 1.0450 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.3200 1.3960 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5730 1.9840 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2480 3.3500 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4900 3.9130 2.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6360 4.7100 3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2500 4.9980 4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4480 4.3940 4.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.6000 3.7460 3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 -3.5030 0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.7610 -5.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -2.1920 -5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -0.6940 -4.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -3.4900 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -3.4700 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -1.3420 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -1.3590 -3.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -0.1270 2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 1.0120 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 2.3150 4.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 1.3330 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 2.0660 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2690 1.2820 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2220 1.3140 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6250 2.0980 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5990 4.0200 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1960 3.2360 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6560 5.0430 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8500 5.6090 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4700 3.1710 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 -3.6990 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 34 2 0 0 0 0 34 55 1 0 0 0 0 35 56 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END