IBS-ZINC02153129 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 1.2000 2.1240 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 0.6470 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 0.0150 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -1.3410 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -2.0690 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -1.4440 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -0.0830 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 0.5510 -2.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 0.4210 -3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 1.1940 -4.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 0.8010 -4.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 0.0280 -2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 1.3380 -6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 0.6060 -7.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7110 0.5200 -6.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 1.3230 -8.4240 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3460 1.1860 -8.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.5390 -9.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6290 0.8510 -9.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 0.8710 -10.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 2.3830 -10.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 2.8150 -12.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 4.2670 -12.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 5.1220 -11.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 4.7310 -10.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1640 4.8530 -9.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 3.2860 -9.9040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8970 2.7890 -8.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1810 2.8970 -8.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 3.5360 -7.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 3.2470 -9.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 5.6370 -9.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -0.8210 -8.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -0.7720 -7.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -1.6690 -6.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 2.6780 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 2.3480 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 2.4170 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 0.5810 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -1.8320 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -3.1280 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -2.0140 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.8260 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -0.6320 -3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 2.2510 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 1.0750 -5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 0.3960 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 1.8540 -3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -1.0290 -3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 0.1470 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 1.3220 -7.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 2.3710 -6.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 0.3500 -11.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 0.5960 -10.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 2.0890 -12.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 4.5240 -12.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 4.4560 -13.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 6.1760 -11.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 4.9420 -11.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 3.1890 -6.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 2.2260 -9.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 3.8960 -9.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 3.5920 -10.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 5.5210 -9.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 5.3600 -8.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 6.6750 -9.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 0.6710 -5.1970 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 10 67 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 11 67 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 13 67 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 M END