IBS-ZINC00532590 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 0.6550 0.8570 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -0.6150 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -0.8560 0.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -2.1080 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.9730 0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -2.4330 2.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2530 -1.8290 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -2.1390 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -1.9120 2.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -3.9160 2.4410 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1520 -4.7640 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -4.2410 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -5.1360 3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -5.4340 5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -4.8380 6.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -3.9430 6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -3.6410 4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.2170 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -5.4330 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -5.4640 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -4.2720 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -3.0160 2.4350 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 1.0980 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 1.0380 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 1.4840 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -0.8560 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -1.2430 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 -4.5460 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -5.8210 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -4.5290 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -5.6020 2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -6.1340 5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -5.0720 7.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -3.4770 7.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.9390 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -6.3270 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -6.3830 2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -4.1040 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 3 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 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 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 M END