IBS-ZINC02102955 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 0.2940 1.9050 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 0.9800 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 0.3730 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 0.6910 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 1.6200 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 2.2240 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 0.0770 -0.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 0.5580 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -0.0760 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 -1.5400 0.9230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -2.0200 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 -1.3860 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3380 -2.1470 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2480 -2.0400 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3410 -2.7660 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5940 -3.0120 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8740 -2.5200 -1.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4750 -3.8070 0.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3410 -3.9900 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1520 -4.3520 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9890 -4.1300 2.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 -3.3540 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8050 -2.9460 1.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0860 -3.3050 3.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0200 -3.1040 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6540 -2.5230 4.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6840 -2.2200 4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5980 -3.5370 5.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5990 -3.7350 5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 -4.8110 4.9120 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9230 -4.8430 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3040 -4.6950 3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 -6.0600 5.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 -7.2260 4.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -3.0530 6.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 -1.3830 4.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0660 -5.1560 2.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 2.3820 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.7330 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -0.3490 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 1.8690 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 2.9460 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 1.6430 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 0.2800 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7270 0.2240 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 0.2560 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 -1.7420 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -3.1050 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -1.6860 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -1.7190 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7150 -6.0770 5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 -6.0440 6.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -8.0570 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -3.6510 7.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -0.8560 5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9270 -5.3290 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8500 -5.5500 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 36 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 36 55 1 0 0 0 0 37 56 1 0 0 0 0 37 57 1 0 0 0 0 M END