PUBCHEM-ZINC06869250 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -1.2520 1.5020 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -0.0180 -0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -0.5960 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.0450 -0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -2.8940 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -2.6810 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -3.8130 -3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -5.0980 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -5.2910 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -4.1670 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -4.1010 0.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -2.8200 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -2.3790 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -2.8880 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -2.3090 4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -1.3600 4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -1.2360 2.3620 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -0.6350 4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 -1.2360 5.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 0.7670 4.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 1.5040 5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 2.5070 6.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 2.6430 5.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 1.6020 4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 4.4990 6.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 5.6460 6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 1.8930 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 1.8990 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 1.8780 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -0.3760 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -0.3600 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.3250 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -0.1880 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -1.6860 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -3.6860 -4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -5.9600 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -6.2880 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -3.6640 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -2.5890 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 2.0300 4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 0.8280 5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1360 3.1260 6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 2.0070 7.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 2.1590 6.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 3.3430 4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 0.9990 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 2.1030 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 4.0150 7.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 4.8750 7.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 6.4500 6.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 5.3370 5.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 6.0590 5.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 3.4440 5.8410 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6120 3.9350 5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 53 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 53 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END