NCID-ZINC05371094 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 1.0110 0.0440 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0020 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 0.9580 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 1.6620 0.6320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3850 2.7010 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 0.8730 -0.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 0.9880 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 0.5830 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 0.1090 -3.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 0.7300 -2.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 0.4600 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 1.2560 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 1.6410 -0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 1.5310 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 1.9580 1.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 1.5570 1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 1.3880 -2.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -0.8230 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -0.2610 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 -1.0700 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -2.4560 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -3.0170 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -2.2030 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -3.3260 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 -2.8370 -0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -4.6620 -0.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5950 -5.5260 -0.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4410 -5.0220 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -6.8370 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 -6.5520 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -7.8430 2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -8.8850 2.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 -5.8200 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -5.3550 -2.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.6760 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 0.4340 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 2.5410 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 2.2100 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 0.5260 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4410 1.1080 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8490 1.7610 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 0.8100 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -0.6330 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -4.0880 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.6360 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -5.0530 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 -7.5140 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 -7.2970 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -5.8740 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 -6.0910 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -0.6350 -2.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -1.2680 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -7.8360 4.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -6.5970 -1.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1360 -6.7570 -2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -8.6890 4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 51 2 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 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 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 14 2 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 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 51 52 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 M END