NCID-ZINC05540995 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 82 0 0 1 0 0 0 0 0999 V2000 -0.6860 1.5750 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 0.0640 -0.3660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2100 -0.2250 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.4210 -1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -0.9800 -2.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -0.1960 -1.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -0.4700 -3.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3250 -0.1330 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 0.2500 -3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 1.7550 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 2.4050 -2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 3.7960 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 4.5430 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 3.9120 -4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 2.5200 -4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 6.0020 -2.9010 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9420 6.5340 -2.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 6.6270 -3.6700 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2090 -1.9830 -3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.7250 -3.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -2.2880 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -3.7220 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -2.5070 -3.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -0.6320 -0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -0.7910 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -0.3350 2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -1.6360 1.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2430 -1.3010 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -3.1170 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -4.0190 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 -4.0140 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2510 -4.8070 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6680 -5.6100 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9530 -5.6420 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 -4.8460 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8760 -6.4170 0.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.3510 -6.5630 -0.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3610 -6.9040 1.4180 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.2260 -1.3520 2.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -1.3050 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4290 -1.5070 1.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -0.9450 4.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4880 -1.5560 4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 0.5560 4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 0.9360 5.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 2.4220 5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 2.7890 7.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 2.0880 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 1.8810 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 1.9340 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 0.1860 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -0.1460 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 0.0210 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 1.8330 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 4.2730 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 4.4810 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 2.0400 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -1.0170 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -3.2570 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -3.4440 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -3.3830 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7950 -4.7760 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 -6.2750 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -4.8740 2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -1.1610 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 0.8730 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6170 1.1310 3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7860 0.7220 6.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 0.3290 6.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 2.6540 5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 3.0320 5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 2.6440 7.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 2.2280 7.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 4.2240 7.4830 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7060 4.4840 8.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 4.8370 7.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 4.4540 6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4890 -1.2970 4.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.9060 -0.9860 5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6250 -2.3150 4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0260 -0.8980 3.3980 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