IBS-ZINC04085658 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -1.1980 -0.0760 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.0840 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -1.0660 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -0.4300 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -0.3310 -1.2830 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9410 -0.8930 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -0.9760 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -0.1290 -3.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 1.0650 -1.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 1.7750 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 1.3030 0.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 3.2000 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 3.9530 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 5.3010 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 5.8680 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 5.1470 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 3.7920 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 6.0360 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6220 7.2590 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 7.1480 -0.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 7.8940 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 0.6510 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -1.0610 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 0.1980 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 0.9250 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -2.0950 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -1.0310 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.8260 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -1.4450 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 0.2350 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 1.4490 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 3.5190 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 5.8810 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 3.2140 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 5.8040 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 8.1960 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -2.2380 -2.7120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 37 -1 M END