NCID-ZINC04715214 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 81 0 0 1 0 0 0 0 0999 V2000 -0.4160 1.2420 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -0.2790 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4470 -0.7650 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -0.9540 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -1.3980 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -1.6600 3.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -1.4780 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -1.0300 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -0.8410 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -1.2580 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -0.1040 -1.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6590 -0.4000 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 0.0300 -3.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5710 -0.5340 -3.7640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6200 -1.6230 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -0.0700 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.6550 -1.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5390 -1.7410 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.0710 -5.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2100 -0.3700 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 1.4180 -5.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 2.1770 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 1.5420 -3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 2.2130 -3.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 3.6330 -4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 4.3820 -3.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 4.1360 -5.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 5.5860 -6.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 6.0780 -6.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2450 6.4240 -7.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 7.0580 -6.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 8.4680 -6.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 9.6300 -6.0730 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 9.6800 -7.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 11.2180 -5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 4.7140 -7.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 3.7740 -6.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 2.0310 -5.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -2.1670 -6.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -0.1340 -7.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -0.4370 -4.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -0.9600 -2.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -1.7320 2.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -0.8730 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 1.6990 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.5980 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.5140 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -0.7540 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -1.5410 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -2.0060 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 1.0180 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -0.4110 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 3.5390 -6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 5.8500 -7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 6.0920 -5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4630 6.7620 -5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 7.0490 -7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 8.7640 -7.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 8.4770 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 11.1590 -5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5960 12.0040 -5.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 11.4460 -6.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 2.9790 -6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -2.3850 -6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -2.5790 -5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -2.6160 -7.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 0.9030 -7.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -0.1740 -7.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.7020 -8.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -0.0490 -4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 0.9670 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -2.6420 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -0.6700 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 6.0010 -5.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 6.8800 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 4.5420 -8.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.7120 -6.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 3.6490 -8.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 44 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 48 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 6 7 2 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 71 1 0 0 0 0 12 13 1 0 0 0 0 12 42 2 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 77 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 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 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 74 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 36 1 0 0 0 0 29 74 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 36 37 2 0 0 0 0 36 76 1 0 0 0 0 38 63 1 0 0 0 0 39 64 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 39 77 1 0 0 0 0 40 67 1 0 0 0 0 40 68 1 0 0 0 0 40 69 1 0 0 0 0 40 77 1 0 0 0 0 41 70 1 0 0 0 0 43 72 1 0 0 0 0 44 73 1 0 0 0 0 74 75 1 0 0 0 0 76 78 1 0 0 0 0 M END