IBS-ZINC04084553 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 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 0.7430 -0.5450 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6460 -1.0620 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -1.4710 2.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -1.0460 1.9860 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7080 -0.1830 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -0.6770 0.1970 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -2.2560 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -2.5700 2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -3.7960 2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -4.7090 3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -4.4080 3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -3.1770 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -2.5990 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -3.0630 3.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 0.6150 2.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 0.8900 3.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 1.3470 1.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 2.4750 2.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7140 2.9620 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 3.4790 1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 4.0720 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 5.2200 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 5.7640 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 5.1600 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 4.0130 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 3.4720 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 1.9740 3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 0.7950 3.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.5260 -1.2830 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 -4.3450 -1.8610 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 -4.0400 2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -5.6610 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -5.1230 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 1.1270 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 4.2730 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 2.9720 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 5.6910 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 6.6600 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 5.5850 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 3.5420 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 2.5780 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -0.1690 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -1.6160 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.1650 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 2.8360 4.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 2.4680 5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 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 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 50 51 1 0 0 0 0 M END