IBS-ZINC05219634 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.2150 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.3110 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.7500 1.3000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6980 -0.3310 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -2.2770 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.2710 2.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.0710 3.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -0.3190 3.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -0.1390 4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 0.3160 5.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 0.5650 5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 0.3670 4.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 1.0190 6.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 0.0610 7.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 0.5590 8.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 2.8460 7.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 2.3470 6.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 2.3680 9.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 0.5290 7.2690 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1490 1.6130 7.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -0.3810 8.0740 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9710 -0.4010 4.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.5600 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.5280 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.6460 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -0.6560 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.7420 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.6960 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.6340 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.5890 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -0.0930 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -0.0310 6.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -0.9120 7.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -0.1350 8.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 0.6250 9.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 2.9380 8.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 3.8180 7.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 3.0420 6.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 2.2820 5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 2.4350 10.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 1.6740 9.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 3.3530 9.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -0.7180 4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -0.2680 5.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 1.8870 8.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 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 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 45 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END