IBS-ZINC06645427 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 43 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -1.7020 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -2.9970 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -3.8860 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -3.4880 3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -2.1920 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -1.2910 2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -0.0240 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 1.2510 2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 2.1800 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 1.9050 4.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 0.7050 4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -0.2680 4.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -1.5410 4.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -1.9350 5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -3.0710 6.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -0.9920 6.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 0.3210 6.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 1.2050 7.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 0.7890 8.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -0.5040 8.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -1.3880 8.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -3.4000 -0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.2910 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.0240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -4.8960 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -4.1860 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 1.5110 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 3.1700 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 2.2130 6.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 1.4750 9.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -0.8160 9.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -2.3940 8.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -3.7740 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 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 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END