PUBCHEM-ZINC03875331 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 81 0 0 0 0 0 0 0 0999 V2000 -0.2580 -1.9150 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -3.1680 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -3.3640 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -2.2690 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -0.9970 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.8330 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -0.0500 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -0.6120 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -2.2780 -0.5220 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 0.0460 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2470 -0.3220 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 0.3620 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8560 1.4180 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 1.7860 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 1.1030 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0330 2.0040 1.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5190 3.0680 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8520 3.5300 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0150 2.6220 1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1990 2.1930 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6210 1.1610 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2830 1.7640 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 1.3520 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 2.1350 -0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 1.8370 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 3.1620 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 3.6110 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 2.7170 3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 1.4320 3.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 1.0200 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 3.2090 5.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 2.2670 6.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 2.9090 7.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 4.3930 9.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 5.7720 9.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 6.4140 8.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 5.2960 7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -1.7720 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -4.0060 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -4.3470 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 0.1450 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -1.1300 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0350 0.0680 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 2.5980 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 1.4060 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6640 2.7200 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 3.9090 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3370 4.2960 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6990 3.9070 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9050 2.0070 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0560 3.6820 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5830 3.0500 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0200 1.7970 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2560 0.9900 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4820 0.2030 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3920 2.5800 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5530 1.0280 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 3.8420 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 4.6340 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -0.0150 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.9510 6.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 1.3920 6.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 2.1580 8.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 3.3540 7.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 4.4150 9.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 3.6550 9.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 5.7030 9.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 6.3290 10.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 7.2630 7.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 6.7830 8.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 5.3140 6.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 5.3130 6.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7950 2.3540 0.9430 N 0 3 0 0 0 0 0 0 0 0 0 0 11.2430 1.6200 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 4.0070 7.9710 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7770 3.6520 7.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 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 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 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 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 73 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 73 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 22 73 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 75 1 0 0 0 0 34 35 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 34 75 1 0 0 0 0 35 36 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 37 71 1 0 0 0 0 37 72 1 0 0 0 0 37 75 1 0 0 0 0 73 74 1 0 0 0 0 75 76 1 0 0 0 0 M CHG 1 73 1 M CHG 1 75 1 M END