IBS-ZINC02254665 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 3.4620 2.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 3.6860 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 3.5750 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 3.8620 5.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 4.2620 6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 4.3770 5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 4.0900 3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 4.1130 2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 4.4340 2.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 4.4010 1.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2360 4.7310 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8090 5.0570 2.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 4.6960 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3420 5.0840 0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1360 5.0840 -0.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3840 5.4170 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2110 5.4170 -1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5590 5.7760 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3280 5.7750 -3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7640 5.4170 -4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4230 5.0590 -4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6460 5.0630 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5250 5.4170 -5.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.8810 5.0380 -6.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 3.7010 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 3.5940 0.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 3.4170 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 3.4030 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 3.2640 4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 3.7730 6.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 4.4830 7.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 4.6880 5.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 4.1400 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5170 5.3840 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 3.6850 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8210 5.6960 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9990 6.0540 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3700 6.0530 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9890 4.7810 -5.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6030 4.7880 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6000 5.0810 -7.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0580 5.7230 -6.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4960 4.0230 -6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 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 1 53 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 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 26 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 M END