IBS-ZINC02274687 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 39 0 0 1 0 0 0 0 0999 V2000 0.0900 1.3970 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -0.0820 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -0.2370 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -0.9250 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.5240 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 0.2390 -2.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.8370 -1.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -2.4330 -2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -3.8810 -2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -4.3850 -1.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -4.5420 -4.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -5.9460 -4.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3680 -6.5240 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -6.1050 -4.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 -5.7860 -3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -6.1870 -3.2670 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 -5.6470 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -6.5220 -5.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -5.6310 -6.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 2.0390 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 1.5560 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 1.7450 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 0.1540 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -1.2850 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 0.3040 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -0.8800 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -1.9800 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -0.5690 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -2.4500 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -2.3950 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -1.8690 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -4.1010 -4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -7.1380 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -5.4570 -5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -4.7210 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -6.3680 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4430 -5.8160 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 -4.5800 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8670 -6.2170 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -7.7810 -5.5930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 M CHG 1 40 -1 M END