NCID-ZINC06018213 MOE2007 3D CORINA 3.40 0006 02.08.2006 79 82 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 0.1370 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -0.4960 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -1.8910 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.6420 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0090 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.7500 0.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -4.0000 2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -4.5830 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 0.3080 4.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 1.5220 4.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -0.3030 5.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 0.5510 6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -0.3150 7.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2960 -1.3000 7.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -1.3520 9.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -0.5120 9.6740 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5610 -1.0970 9.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 0.5430 8.5420 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7320 0.9340 8.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 1.6000 8.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 0.1240 10.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -0.7600 12.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1840 -1.7610 11.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -0.2580 13.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5830 -0.9590 14.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 1.1160 13.6370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4260 1.4560 14.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 1.0050 14.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5630 0.3240 14.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 0.5040 13.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 -0.8000 12.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9940 -1.5040 13.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -1.2140 11.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 -1.5020 11.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 -1.9330 10.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3840 -2.2370 11.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7170 -3.5180 11.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0020 -3.7990 12.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9600 -2.7960 12.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6230 -1.5110 11.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3380 -1.2360 11.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2250 -3.0700 12.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 2.3860 14.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 2.2650 15.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 2.0500 12.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -0.1510 12.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 -1.0150 6.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2150 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -2.3820 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -2.9550 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -4.2490 3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -4.2740 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -5.6690 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 1.1930 5.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 1.1680 6.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -0.9480 7.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -2.2900 7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 2.1620 9.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5710 -0.6110 12.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1110 -2.3060 12.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5440 -2.8240 10.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0050 -1.1290 10.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9710 -4.2990 11.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2620 -4.8000 12.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3670 -0.7280 11.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0770 -0.2380 10.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8190 -3.3500 11.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 3.0430 13.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 2.8060 15.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7160 3.1040 15.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 2.9430 12.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 0.1610 13.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 -1.5980 6.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 55 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 11 57 1 0 0 0 0 11 58 1 0 0 0 0 11 59 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 60 1 0 0 0 0 15 61 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 62 1 0 0 0 0 17 63 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 64 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 34 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 49 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 48 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 46 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 38 39 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 39 40 1 0 0 0 0 39 44 2 0 0 0 0 40 41 2 0 0 0 0 40 69 1 0 0 0 0 41 42 1 0 0 0 0 41 70 1 0 0 0 0 42 43 2 0 0 0 0 42 45 1 0 0 0 0 43 44 1 0 0 0 0 43 71 1 0 0 0 0 44 72 1 0 0 0 0 45 73 1 0 0 0 0 46 47 1 0 0 0 0 46 74 1 0 0 0 0 46 75 1 0 0 0 0 47 76 1 0 0 0 0 48 77 1 0 0 0 0 49 78 1 0 0 0 0 50 79 1 0 0 0 0 M END