IBS-ZINC05477916 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 0.0100 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 1.1960 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 1.8480 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.7360 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.3710 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -1.7570 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -2.2730 -1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 -3.6590 -1.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -4.7380 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -4.7170 -1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 -5.9520 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -7.3120 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -8.2160 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8360 -7.7690 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 -6.4110 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -5.4970 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 -4.0210 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9340 -3.2620 -1.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5070 -5.9400 -1.7940 N 0 3 0 0 0 0 0 0 0 0 0 0 9.4170 -6.7470 -1.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7450 -4.7470 -1.8430 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 2.8660 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 0.7170 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 -1.8010 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -2.3760 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -2.2290 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -1.6540 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -7.6670 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -9.2760 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6440 -8.4820 -1.6560 H 0 0 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END