IBS-ZINC02274686 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 39 0 0 1 0 0 0 0 0999 V2000 -0.3060 1.3710 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -0.0870 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -0.9440 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -0.1340 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.5990 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 0.1010 -1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -1.8990 -1.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -2.5550 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -3.9670 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -4.4000 -2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -4.6820 -3.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -6.0670 -3.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7860 -6.6220 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -6.1480 -5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -5.7220 -5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -6.0300 -6.8410 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -5.3750 -6.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -6.7420 -3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 -5.9160 -3.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 1.4530 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 2.0210 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 1.7670 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.5430 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -1.9780 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.9760 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 0.4170 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -1.1600 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 0.3080 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -2.4590 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -1.9840 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -2.5930 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -4.3010 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -5.5220 -5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -7.1800 -5.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -6.2840 -4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -4.6530 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -5.4780 -7.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -5.9310 -5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -4.3150 -6.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -8.0030 -3.6400 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