IBS-ZINC04041040 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0760 -4.6440 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -4.7990 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -6.3250 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -8.2940 -1.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1050 -8.6280 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -8.9050 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -8.7320 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -9.7650 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7360 -10.1670 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5740 -9.5360 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -8.5020 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -8.0970 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -4.7560 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -5.5220 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -5.7320 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -5.0820 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -4.4980 -2.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -4.3800 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -4.5050 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -6.7450 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -6.6200 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -8.5880 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -9.9920 -2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -8.5710 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -10.2580 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1110 -10.9750 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6030 -9.8500 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -8.0090 -3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 -7.2870 -2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -5.9020 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -6.3040 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -5.0410 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -6.8280 -1.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -6.4050 -0.9390 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 48 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 48 49 1 0 0 0 0 M END