IBS-ZINC00844712 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 0.2200 1.4400 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -0.0880 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.5910 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -0.5300 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -1.9910 -0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -2.7240 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0780 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -2.8160 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -4.2020 3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -4.8570 2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -4.1280 0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -4.8140 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -4.0380 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -2.5830 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -1.8970 -2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -4.6760 -2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -4.8070 -3.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 -5.1150 -3.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -5.8480 -4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -6.2240 -4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -5.3640 -5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -5.7050 -6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -6.9100 -5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -7.7760 -4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 -7.4310 -4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 -8.8830 -4.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7200 -8.8700 -5.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8860 -7.4740 -5.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -6.1600 -0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 1.7540 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 1.7980 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 1.8550 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.5030 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -1.6800 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -0.2770 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -0.1760 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -0.1890 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -0.0970 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -1.0000 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -2.3110 4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -4.7660 4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -5.9360 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -4.9460 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -5.2180 -5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -6.7510 -4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -4.4240 -6.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7230 -5.0310 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -8.1020 -3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 -9.4350 -6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6230 -9.2690 -5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -6.5040 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 29 51 1 0 0 0 0 M END