PUBCHEM-ZINC01437865 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.5930 1.5160 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 0.0770 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.5440 1.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -1.8560 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -2.5010 0.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.3970 2.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8290 -2.0370 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -1.9040 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -4.2690 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -3.9370 2.4030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2040 -4.3360 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -4.5860 3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -5.1780 2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -5.7960 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -5.8190 5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -5.2170 5.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -4.5990 4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -6.4810 6.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4050 -6.9140 5.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -6.5700 7.1950 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0250 -2.9160 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 -1.7580 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 -1.8490 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -0.7690 5.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8320 0.4120 4.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5240 0.5150 3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -0.5630 2.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 1.5590 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 2.0340 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 2.0520 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 0.0480 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -0.4540 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -1.8390 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -0.9540 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -5.0190 3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -4.5650 1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -5.1620 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -6.2500 3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -5.2170 6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -4.1330 5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -2.8930 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 -3.8580 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -2.7630 5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -0.8490 6.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2890 1.2510 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7370 1.4370 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -0.4580 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -2.9670 3.1080 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3550 -2.8440 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 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 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 48 1 M END