IBS-ZINC00544260 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 41 0 0 0 0 0 0 0 0999 V2000 -0.0460 1.3260 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.0560 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -0.7230 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -0.0030 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 1.3850 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 2.0460 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -0.6760 -0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -0.2670 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -1.2370 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -2.2210 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -1.8810 0.5830 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0560 -1.0400 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1890 -1.7040 -0.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0790 -1.0780 -1.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5690 0.0250 -2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 0.0880 -1.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 0.9680 -1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 0.7950 -1.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 1.0100 -3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 1.0520 -3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3250 1.9720 -3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5990 2.8580 -4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2110 2.8200 -4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5480 1.8980 -3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2480 3.7640 -5.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 1.8450 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -0.6160 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -1.8020 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 1.9480 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 3.1260 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 -3.1050 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 1.8460 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2360 0.3640 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4050 2.0050 -3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6490 3.5110 -5.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 1.8660 -3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4480 3.4460 -6.2790 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 M END