IBS-ZINC05342099 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 -1.2710 1.1230 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -0.3450 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -0.7540 0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -1.2280 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -0.6270 -1.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -0.0220 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 0.7980 -0.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -0.4340 -2.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 0.0980 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 0.5980 -3.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -0.4100 -4.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -0.8550 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -1.4240 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 0.2760 -6.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 0.6720 -7.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 1.2620 -8.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 1.4680 -8.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 1.0930 -7.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 0.5100 -6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6030 -1.6790 -4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -1.8290 -3.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -2.6270 -5.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -3.9580 -5.7590 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0520 -4.2610 -4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 -4.9800 -6.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 -5.2810 -5.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -4.7040 -4.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -6.2760 -6.5940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -6.5300 -6.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -6.7710 -7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -4.0160 -6.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -3.3530 -7.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.7990 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 1.4180 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 1.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -0.6960 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -1.7780 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -0.1120 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -0.9900 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -2.2860 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -1.1040 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 0.9200 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 -0.6990 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 1.5330 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 0.8620 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 0.0070 -4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -1.5970 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -2.3200 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -1.7230 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 0.5280 -6.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 1.5550 -9.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 1.9140 -9.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 1.2390 -8.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 0.2150 -6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 -2.3920 -6.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -4.6260 -7.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -5.9310 -6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2210 -4.7640 -5.7950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 31 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 31 32 2 0 0 0 0 31 58 1 0 0 0 0 M CHG 1 58 -1 M END