IBS-ZINC05443478 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 0.1040 0.2510 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -0.7760 3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -1.2000 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -0.5910 2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 0.4430 1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 0.8590 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -1.0430 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -0.5450 1.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -1.2400 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 -2.1240 2.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -1.9930 2.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 -1.0900 0.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 -2.1280 0.0190 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2410 -3.3530 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -3.4550 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 -4.6940 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -5.8360 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 -5.7440 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -4.5120 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1820 -1.9990 -0.4340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9100 0.5770 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -1.2470 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -2.0020 3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 0.9180 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 1.6600 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -2.5640 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 -4.7740 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 -6.8040 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9650 -6.6390 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0670 -4.4420 0.3610 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 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 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 20 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 26 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 M CHG 1 13 1 M CHG 1 20 -1 M END