IBS-ZINC06758973 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8060 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -0.2900 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -1.5310 -1.8880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -1.8020 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -3.0580 -3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -2.9970 -4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -1.3290 -5.2520 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -0.7280 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 0.5810 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 0.7540 -2.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 1.9690 -4.3250 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 3.3140 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 4.6380 -3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 4.6700 -4.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 5.7880 -3.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 7.0090 -3.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 8.1690 -3.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 9.2290 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 8.9520 -5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 7.2000 -5.3610 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -4.2060 -5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -5.4340 -4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -5.5020 -3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -4.3710 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1830 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1670 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1570 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 3.2330 -3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 3.2480 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 5.7630 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 10.2390 -3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 9.6750 -5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -4.3650 -6.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -4.0420 -5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -6.3350 -5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -5.3510 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -5.3920 -4.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -6.4620 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -4.5630 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -4.3110 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END