IBS-ZINC05050105 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.0480 1.0530 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.9280 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 2.9280 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 3.4270 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 4.8860 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 5.8550 -0.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9590 5.7220 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 7.2230 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 7.0260 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 5.5740 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 5.0760 1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 8.0030 0.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 8.5140 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 9.2590 0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 8.9110 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 8.1120 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 8.4850 -4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 9.6490 -4.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 10.4490 -3.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 10.0870 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 11.5900 -4.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 11.9050 -5.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 5.6860 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 5.6050 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 5.4500 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 5.3760 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 5.4570 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 5.6070 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 5.3850 -1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 5.2260 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.0350 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.4240 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.4650 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 1.3520 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.1570 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 1.1890 3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 3.3750 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 3.2110 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 3.1440 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 2.9800 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 7.6760 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 7.2030 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 7.8670 -5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 9.9350 -5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 10.7110 -1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 11.1030 -6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 12.0140 -5.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 12.8380 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 5.6620 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 5.3870 2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 5.2560 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 5.6660 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 5.1830 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 6.0710 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 4.3030 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.4660 1.0300 N 0 0 0 0 0 0 0 0 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 1 56 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 56 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 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END