IBS-ZINC04082061 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 0.3040 1.3600 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.1220 -0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0710 -0.2790 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.9540 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.6120 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -1.4320 3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -2.2090 3.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -0.5510 -1.3430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6480 -0.2860 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -2.0720 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -2.2250 -3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -0.8680 -3.6400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2990 -0.8480 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 0.0950 -2.5030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2030 1.5040 -2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 1.8910 -4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 0.8320 -4.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0470 0.7460 -4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -0.5390 -4.9620 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2100 -1.3060 -5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -0.6210 -6.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9900 -1.6550 -6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.2120 -7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 1.2170 -7.3250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3650 1.8760 -6.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 1.2870 -6.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0880 2.7300 -6.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 3.2090 -7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 3.1130 -8.6170 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8440 3.4070 -9.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 1.6820 -8.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 3.9990 -8.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 0.3820 -6.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 0.2220 -5.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 0.0020 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 1.5410 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 1.9620 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.6310 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -2.0140 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -0.7300 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.4480 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -0.8360 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -2.5950 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -2.4640 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -3.0320 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -2.3980 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 2.2010 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 1.6080 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 2.8250 -4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 2.1070 -4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -0.2410 -8.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -0.9030 -7.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 2.7780 -5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 3.3780 -5.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 2.6300 -7.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 4.2580 -7.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 1.6620 -9.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 1.0210 -9.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 4.9280 -8.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 0.4700 -6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 0.6860 -7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -0.6520 -6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 0.2140 -6.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 0.6510 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 0.3170 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -1.0270 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -1.2980 4.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -1.8450 5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 67 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 33 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 67 68 1 0 0 0 0 M END