CHEMBRIDGE-ZINC02170566 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 -0.8270 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 0.5180 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 -0.0710 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5510 1.0150 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8680 0.7320 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2410 -0.4250 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8630 1.8310 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2300 1.5180 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1560 2.5210 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6970 3.8520 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5940 4.9320 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1140 6.2060 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7420 6.4540 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8430 5.4330 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3000 4.1010 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4420 3.0810 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 1.9770 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 1.1370 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 1.1280 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7130 -0.6900 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 -0.6810 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 1.9380 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5500 0.4860 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2130 2.3000 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6590 4.7540 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8050 7.0360 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3860 7.4740 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7840 5.6430 -0.0520 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 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 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 M END