IBS-ZINC03882098 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.6740 1.3510 -1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -0.0430 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -0.7580 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -0.0280 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 1.3680 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 2.0650 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 3.5460 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 4.0830 -1.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 4.2190 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 5.6770 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8390 6.1400 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 6.2370 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 6.1760 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 6.9030 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 6.9410 -4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 6.1910 -5.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 6.0410 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 5.0630 2.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -2.1310 -0.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -2.9880 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -4.4700 0.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9030 -4.7040 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -5.4100 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -5.4630 1.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 -5.3530 2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -5.0070 2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -4.8890 3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -4.4690 3.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -5.2240 4.8600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -5.1790 5.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.5750 4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -5.6260 3.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -5.8630 6.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -4.6960 1.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -4.5390 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -4.1190 -0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 1.8750 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -0.5700 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -0.5330 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 1.8820 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 3.7450 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 7.2850 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 5.6970 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 5.1320 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 6.6330 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 7.9410 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 6.4330 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -2.5850 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -2.8810 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -2.6730 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -6.4210 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -5.1030 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 -5.6320 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -5.8340 7.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -6.1240 6.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -4.8400 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 7.7310 -5.4370 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1890 7.2300 1.8930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 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 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 57 1 0 0 0 0 17 18 2 0 0 0 0 17 58 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 32 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 35 56 1 0 0 0 0 M CHG 1 57 -1 M CHG 1 58 -1 M END