IBS-ZINC02124265 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 1 0 0 0 0 0999 V2000 0.1590 1.4520 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 0.0660 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -0.6800 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 0.0190 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 1.4080 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 2.1340 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 1.7780 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 0.5980 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -0.4440 0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -1.4150 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 3.1810 0.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4240 3.8970 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 3.4540 1.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3630 4.5360 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 3.0940 0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 3.3690 -0.7740 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0810 3.4640 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 3.8000 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 4.5800 -2.4060 O 0 5 0 0 0 0 0 0 0 0 0 0 7.3190 3.5930 -1.5330 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0990 2.7870 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.9990 2.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 2.0140 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -0.4470 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -1.7600 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 3.2150 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 0.4170 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 3.2670 -3.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 3.1420 3.1090 O 0 5 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 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 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 28 2 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 M CHG 1 16 1 M CHG 1 19 -1 M CHG 1 20 -1 M CHG 1 29 -1 M END