IBS-ZINC05141851 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -5.6930 0.5500 -5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -0.4130 -5.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 0.3660 -5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -1.1170 -3.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 -2.4170 -3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -3.1050 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -4.4360 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -5.0770 -3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -4.4060 -4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -3.0730 -4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -6.4700 -3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -7.2830 -2.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -6.8020 -3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -7.9780 -4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -7.9570 -4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -8.8690 -4.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -6.7400 -3.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -5.8960 -3.4360 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2200 -5.0370 -4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -5.4350 -1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -4.0650 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -3.6180 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -4.5330 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -5.8950 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -6.3450 -0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -6.3340 -3.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -5.7840 -5.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -5.3010 -6.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -4.3580 -4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -9.0350 -4.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 1.1380 -6.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6190 -0.0040 -4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 1.2360 -4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -1.0860 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 1.0470 -4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -0.3060 -5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 0.9510 -6.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -2.5980 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -4.9590 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -4.9050 -5.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -2.5750 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -3.3290 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -2.5560 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -4.1860 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -6.6090 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -7.4140 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -5.6030 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -7.2200 -3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -6.5200 -5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -4.8530 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -4.4180 -6.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -6.1970 -7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -5.1670 -6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -4.6190 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -3.4630 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -4.2150 -4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -9.7230 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -5.5050 -5.0380 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7480 -6.3490 -4.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 58 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 58 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 58 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END