IBS-ZINC04702847 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -2.6700 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -4.0240 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -4.5820 1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -3.7250 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.3350 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -4.3070 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -5.6210 3.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -6.3950 2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -5.9060 1.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -7.7720 2.9070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -8.6000 1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -8.8830 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -10.8230 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -9.9650 2.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -11.0930 -1.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2600 -12.1170 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -11.0560 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -11.9440 -1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -11.4300 -3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -11.4670 -3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -10.5790 -2.5070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2260 -9.5550 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -10.6160 -2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -3.4480 4.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -2.2430 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -4.6640 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -1.6730 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -8.1530 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -8.9410 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -8.4100 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -11.8330 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -10.8480 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -10.3510 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -11.4220 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -10.0320 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -12.9680 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -11.9180 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -12.0630 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -10.4060 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -12.4910 -3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -11.1010 -4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -11.6400 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -10.2500 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -9.9830 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -3.2550 5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -3.9650 5.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -2.5030 4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -8.0800 0.9370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -10.2400 -0.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 18 1 0 0 0 0 15 57 2 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 58 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 19 58 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 M END