NCID-ZINC05540990 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 82 0 0 1 0 0 0 0 0999 V2000 0.2380 1.5660 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 0.0560 -0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7490 -0.4270 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -0.5100 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -0.9220 -1.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -0.4990 0.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -1.0780 0.7830 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2190 -2.0250 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -1.2890 2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -2.1120 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -1.6570 4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -2.4050 5.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -3.6190 4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -4.0980 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -3.3450 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -4.4030 5.8520 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8950 -4.2550 7.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -5.1640 5.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.2650 -0.1790 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 1.1630 0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 1.5260 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 1.8040 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 -0.6020 -0.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -0.3160 -1.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -0.3330 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -0.0180 -0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -0.7670 -2.7610 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2980 -1.6170 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 0.4090 -3.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 0.0040 -5.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -0.7540 -5.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -1.1800 -7.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.8430 -7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -0.0740 -7.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 0.3480 -5.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -1.3140 -9.0870 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1310 -1.7460 -9.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -1.2600 -9.4320 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2860 -1.2150 -2.5800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -2.3700 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -3.1250 -3.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 -2.6970 -2.8070 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8430 -1.8110 -2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -3.1910 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 -3.1820 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7320 -3.5150 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1180 -3.3920 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 1.9830 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 2.0550 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 1.8390 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -0.1190 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -0.3050 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -1.7700 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -0.7150 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -2.0300 6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -5.0480 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -3.7360 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.5900 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 0.8340 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 1.2260 -3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.0280 -5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -1.7760 -7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 0.2030 -7.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 0.9460 -5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 -0.6320 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -2.5520 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -4.2000 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3680 -3.9050 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 -2.1910 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 -2.8360 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 -4.5320 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8210 -4.1180 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5240 -2.3820 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 -3.6630 2.7710 N 0 3 0 0 0 0 0 0 0 0 0 0 9.9400 -3.5340 3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7240 -4.6270 2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3640 -3.0290 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7290 -3.7570 -3.7410 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6910 -4.0650 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 -3.4250 -4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 -4.5740 -3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 51 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 9 52 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 55 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 56 1 0 0 0 0 15 57 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 39 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 63 1 0 0 0 0 35 64 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 39 40 1 0 0 0 0 39 65 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 78 1 0 0 0 0 44 45 1 0 0 0 0 44 66 1 0 0 0 0 44 67 1 0 0 0 0 45 46 1 0 0 0 0 45 68 1 0 0 0 0 45 69 1 0 0 0 0 46 47 1 0 0 0 0 46 70 1 0 0 0 0 46 71 1 0 0 0 0 47 72 1 0 0 0 0 47 73 1 0 0 0 0 47 74 1 0 0 0 0 74 75 1 0 0 0 0 74 76 1 0 0 0 0 74 77 1 0 0 0 0 78 79 1 0 0 0 0 78 80 1 0 0 0 0 78 81 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 36 1 M CHG 1 38 -1 M CHG 1 74 1 M CHG 1 78 1 M END