IBS-ZINC05164813 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.1420 1.3760 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.1350 0.3270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5940 -0.6350 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -0.4460 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 0.2090 1.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5350 1.2920 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -0.3020 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 0.0200 -1.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -0.6370 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -0.3130 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 0.6720 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 0.2910 -4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -0.9940 -4.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -1.9040 -3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -1.5770 -2.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -3.2300 -4.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -3.6120 -5.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -4.2520 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 1.2370 -5.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 2.0900 -3.0760 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5990 2.8160 -2.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 2.5320 -3.3530 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6140 -0.1450 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 1.8740 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.5970 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 1.7330 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -0.0520 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -1.5260 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 0.1740 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -1.3830 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -1.7160 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.4050 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -3.0960 -5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -4.6890 -5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -3.3350 -6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -4.6440 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -5.0630 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 -3.8100 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 2.1710 -5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 0.9640 -6.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -1.2280 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 0.3220 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 0.2170 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END