PUBCHEM-ZINC03780890 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 0.1300 1.8220 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 0.4320 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -0.4160 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 0.1490 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 1.5370 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 2.3850 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 1.8980 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 0.6100 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -0.5590 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6210 -1.3220 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -1.0720 1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -2.3780 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -2.8570 2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -4.1820 3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -5.0660 2.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -4.5150 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -3.2530 0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -4.3810 4.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -3.1830 4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 -2.2410 3.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 -5.6290 5.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9240 -6.3060 4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 -6.2630 5.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8030 -5.4630 5.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 -7.1070 6.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8810 -7.3470 7.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 -6.2930 7.4140 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2210 -6.9180 7.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -5.3630 6.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -5.4650 8.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -4.8010 9.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -4.4210 8.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 -8.3560 6.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -8.3950 5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 -7.0820 4.2460 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7370 2.4660 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 0.0120 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -1.4930 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 3.4590 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 2.7560 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 2.0960 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 0.6790 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 0.4820 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -0.4810 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -5.1710 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 -3.0640 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -6.0970 9.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 -4.6940 7.9990 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 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 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 44 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 20 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 35 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 33 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 35 -1 M END