IBS-ZINC04295184 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -2.1480 1.0440 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -0.3370 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -1.1890 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -2.5260 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -3.0740 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -2.2360 -1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -0.8570 -1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.3340 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -1.4030 -3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -2.5390 -2.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -3.8690 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -1.2730 -4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -0.1890 -5.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -2.4810 -5.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -2.4240 -6.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 0.9680 -2.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 2.0670 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 2.0820 -0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 3.3840 -2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 5.8340 -2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 6.8520 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 6.9310 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 5.5410 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 4.5340 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 7.9120 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 1.6730 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 1.5150 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 0.9850 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -0.8030 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -3.1570 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -4.1350 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -4.2460 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -3.8110 -3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -4.5430 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -1.9080 -6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -3.4490 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -1.9280 -7.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 1.0540 -3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 3.3290 -3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 3.6420 -3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 5.7210 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 6.1140 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 7.8360 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 6.5840 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 7.3030 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 5.5960 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 5.1870 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 4.8060 -2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 3.5300 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 7.5940 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 7.9910 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 8.9120 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 4.4960 -1.9450 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5850 4.2120 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 53 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END