IBS-ZINC02213233 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.3790 1.2860 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -0.0870 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -0.6540 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 0.2130 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 1.5850 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 2.1370 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 2.2100 -0.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 1.2570 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 0.0250 0.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 -1.2540 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 -1.7840 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 -2.1110 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8600 -2.6080 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 -2.7960 -3.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 -2.4940 -3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -1.9940 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -3.4090 -4.5790 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 1.4700 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 1.1800 1.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 0.7950 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 0.2820 2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3450 -0.1890 2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2560 -0.1600 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8260 0.3600 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 0.8260 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6640 -0.6750 1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9560 -1.1860 2.9720 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3820 1.7010 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -0.7300 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.7230 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 3.2050 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -1.1130 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -1.9840 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 -1.9720 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9200 -2.8440 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -2.6450 -4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 -1.7670 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0200 0.8590 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 2.5150 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 1.2910 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3590 0.2300 3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 -0.5870 3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5160 0.3990 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2380 1.2200 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4540 -0.5590 0.8560 O 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 18 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 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 2 0 0 0 0 M CHG 1 27 -1 M END