IBS-ZINC04980907 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 2.5310 2.5980 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 2.6110 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 4.1860 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 4.3110 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 5.7180 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 5.8370 3.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 6.2800 5.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3880 5.6060 5.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 6.2360 5.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 5.8070 4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 5.5670 3.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 5.1800 2.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 5.6310 4.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 6.5900 6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 7.5340 7.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 5.7980 8.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 4.6450 7.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 3.9090 9.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 4.3090 10.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 5.4540 10.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 6.2040 9.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 5.8410 11.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 5.0240 12.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 7.6850 5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 8.6390 4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 9.9300 4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 10.2690 5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 9.3140 6.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 8.0210 6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 9.6460 7.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 10.9960 7.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 1.5920 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 3.3250 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 2.7030 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 3.2920 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 1.5820 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 2.7930 4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 4.3640 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 4.9210 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 3.5760 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 4.1330 4.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 6.4530 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 5.8950 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 5.3180 3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 4.3290 6.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.0180 8.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 3.7290 11.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 7.0970 9.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 4.0150 12.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 4.9890 12.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7440 5.4450 13.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 8.3760 3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 10.6730 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 11.2770 5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 7.2770 6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 11.2220 6.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 11.6700 7.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 11.1260 8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 2.8350 2.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 59 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END