NCID-ZINC05385836 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 3.1280 -2.3330 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -2.0940 -3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -1.3980 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -0.9500 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 -1.1670 -2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -1.8650 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -0.2370 -0.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 0.1000 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 1.4930 0.8620 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -0.7050 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 -2.1160 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -2.8940 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -2.4070 0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 -4.2450 0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -4.7840 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 -4.8580 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 -4.2020 -0.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 -2.8320 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9410 -2.1570 -1.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0810 -0.7170 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1700 -0.1260 0.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1210 0.9580 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 -0.3930 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0580 0.2110 2.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 0.1290 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6130 0.7350 4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9330 0.6720 6.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 -0.0170 6.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9050 -0.6100 5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5780 -0.5370 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 -0.0950 8.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 0.8510 8.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9460 -1.2850 8.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4840 -1.5850 9.8120 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9460 -0.9870 10.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9970 -1.3140 9.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3630 0.1610 9.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8560 0.4830 9.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6550 -0.4930 9.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3090 -3.1050 10.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1650 -3.8250 9.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 -6.2040 -0.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -2.8730 -5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -2.4490 -3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -1.2280 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -0.7770 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 -2.0340 -4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 0.1180 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6860 -2.7530 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1290 -0.4380 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -0.3290 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 -1.4710 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8250 0.0220 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 0.7120 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 1.2610 4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 1.1480 6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8200 -1.1190 5.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 -1.0140 3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9950 -2.0920 7.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3920 -1.6610 10.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5080 -1.9060 9.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0450 0.5110 8.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8300 0.7580 10.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 -6.7580 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4950 -6.6800 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1170 1.7180 9.9120 O 0 5 0 0 0 0 0 0 0 0 0 0 9.3020 -3.4300 11.3360 O 0 5 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 43 1 0 0 0 0 2 3 2 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 45 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 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 40 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 37 38 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 38 39 2 0 0 0 0 38 66 1 0 0 0 0 40 41 2 0 0 0 0 40 67 1 0 0 0 0 42 64 1 0 0 0 0 42 65 1 0 0 0 0 M CHG 1 66 -1 M CHG 1 67 -1 M END