PUBCHEM-ZINC04450720 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 -0.3620 1.6290 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.2730 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -0.3830 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 0.3120 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 1.6840 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 2.3230 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 2.4730 1.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 2.1380 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 0.9050 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -0.3920 1.8300 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7380 -1.1740 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -0.4060 0.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -1.1080 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 -1.8920 -0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -0.8320 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -1.1650 -3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -0.7570 -4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -0.3400 -4.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -0.8320 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 0.0390 3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -0.4630 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -1.8310 4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -2.7100 4.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -2.1910 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 0.7430 2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -0.2490 3.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 1.8230 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 3.1670 2.7590 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0320 3.1320 3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 3.3630 1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 4.3210 2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 5.1570 3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 6.2220 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2230 6.4570 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0480 5.6470 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 4.5820 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0890 7.4790 2.5060 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 2.1500 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.2750 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -1.4510 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 3.3840 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 3.4710 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -1.4400 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 0.2250 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -0.6650 -2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 -2.2440 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 1.1130 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 0.1990 5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.2690 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -2.9280 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9190 1.6550 3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 1.7380 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 3.6640 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 4.2020 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 4.9830 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6630 6.8660 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 5.8470 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 3.9590 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -0.8910 -5.3160 O 0 5 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 12 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 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 59 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 34 35 2 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 36 58 1 0 0 0 0 M CHG 1 59 -1 M END