IBS-ZINC05451435 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 47 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3770 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 1.8630 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.1940 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0300 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -0.4560 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.2190 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.6510 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 0.0370 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 1.2500 -0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 -0.7010 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 0.2640 -0.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 0.7800 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 0.5750 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 1.2410 2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5910 2.1180 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7020 2.3340 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8500 1.6690 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 1.6720 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6700 0.7880 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 0.5960 -2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 -0.1680 -3.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0020 1.2680 -3.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0020 2.1100 -3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3300 2.3050 -2.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7180 2.8530 -4.9700 S 0 0 0 0 0 0 0 0 0 0 0 0 8.6470 2.0180 -6.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7290 1.1470 -5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 2.7680 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 1.5740 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -1.3600 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -0.1590 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -1.6180 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -1.3300 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -1.3240 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -0.1040 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5590 1.0800 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2510 2.6330 3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4470 3.0180 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 2.7480 -6.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2410 1.4000 -6.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8570 0.1050 -5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 1.4370 -5.5100 H 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 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 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 19 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 M END