PUBCHEM-ZINC04098773 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -1.3310 1.0080 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -0.1600 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -0.8200 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -1.8600 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -2.3950 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -1.7320 3.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -2.6800 4.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -3.8590 4.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -3.7170 3.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -2.4610 6.4010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8310 -1.4070 6.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -2.8160 6.8190 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6630 -3.8900 6.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -2.6680 8.3540 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5300 -1.6220 8.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -3.5160 9.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7730 -4.5780 8.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -3.1130 8.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9730 -2.0660 8.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -3.2720 7.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -3.9900 9.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -3.6200 8.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -3.5280 7.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -3.3140 10.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -3.3310 10.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -3.0960 8.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 -2.7600 8.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -1.9540 6.3140 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2880 -0.6880 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.7370 -1.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 0.0970 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -0.5170 -3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 0.1730 -4.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -0.2160 -5.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 0.4000 -6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 1.4020 -7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.7850 -6.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 1.1700 -5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 1.8910 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 1.1370 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 0.8950 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.3050 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -0.0420 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -1.4210 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -2.6800 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -0.7130 4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -4.7780 4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -3.8780 10.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -5.0460 8.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 1.1640 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.5830 -3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -0.9960 -5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 0.0970 -7.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.8800 -8.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 2.5590 -6.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 1.4710 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 52 1 0 0 0 0 35 36 1 0 0 0 0 35 53 1 0 0 0 0 36 37 2 0 0 0 0 36 54 1 0 0 0 0 37 38 1 0 0 0 0 37 55 1 0 0 0 0 38 56 1 0 0 0 0 M CHG 1 28 -1 M END