PUBCHEM-ZINC05818960 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 0 0 0 0 0 0999 V2000 -0.0870 1.9320 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 0.4110 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -0.3060 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 0.2180 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 0.0300 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -1.8480 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -2.4990 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -3.8870 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -4.6710 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -4.0730 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -2.6600 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -4.8980 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9360 -4.0420 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -6.0240 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -5.4780 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 -6.3280 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -6.0390 0.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -6.7090 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -6.6290 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -7.3140 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -8.0870 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -8.1840 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -7.5060 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -7.6390 2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -7.8450 2.9460 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3200 -8.8100 -1.0180 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6520 -8.6680 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -9.5240 -0.2050 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9120 2.3030 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 2.2570 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 2.4150 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 0.0170 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 0.1740 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 1.2960 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -0.2470 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 0.0150 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -0.3080 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -0.4400 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 1.1060 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -1.9560 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -4.3510 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -2.1520 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -3.5370 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 -4.6540 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -3.2830 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -6.8560 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -6.4610 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -5.6440 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -6.0960 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -4.6510 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -7.1870 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -6.7140 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -5.7460 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -6.0320 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -7.2330 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -8.7840 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -7.5650 3.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 57 2 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 26 1 M CHG 1 28 -1 M END