IBS-ZINC05427868 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -1.9890 1.6760 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 0.1980 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -0.5140 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -1.8710 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -2.5220 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -1.8100 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -0.4440 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -2.5050 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -3.8200 -2.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -3.9910 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -2.8000 -4.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -1.9620 -3.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -5.2870 -4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 -5.9740 -4.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -5.7180 -6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -4.2600 -6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -5.9860 -7.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -6.8410 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -6.9860 -3.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -7.6300 -4.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -8.4340 -3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -9.7890 -3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -10.5270 -2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -9.9100 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -8.5550 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -7.8160 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 -6.3640 -2.3410 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3040 -5.8100 -1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 -5.7240 -3.3240 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0530 2.2300 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 1.9590 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 1.9080 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -0.0080 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.4220 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -3.5820 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 0.1110 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -5.0800 -5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -5.9210 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -6.3760 -6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -3.6050 -6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -4.1000 -7.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -4.0360 -5.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -6.9940 -7.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -5.8940 -8.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -5.2620 -7.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -6.9460 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -8.3020 -5.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -10.2710 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -11.5850 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -10.4860 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -8.0730 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END