IBS-ZINC04124033 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 1.3810 -0.5480 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.3550 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.8770 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 1.9200 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 1.7450 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.4940 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 2.7360 0.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 4.1140 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 5.0870 0.3410 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 4.5970 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 5.9940 -0.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1320 6.6050 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 6.1650 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 7.6010 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 7.9280 -1.8070 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 7.7380 -2.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 9.1490 -1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 6.5240 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 1.0750 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 2.1860 -2.3320 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5520 -1.5110 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -1.1730 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 2.8510 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 0.3160 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 2.3870 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 3.9010 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 5.9580 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 5.4710 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 8.2970 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5720 7.7460 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 5.7910 -2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 6.8460 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 0.1140 -1.7950 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 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 19 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 2 0 0 0 0 M CHG 1 20 -1 M END