PUBCHEM-ZINC05595815 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 5.6960 -3.2190 3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -3.6230 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -2.6900 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -3.0740 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -4.4000 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -5.3320 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -4.9520 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -4.7930 0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -5.7150 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -6.1060 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -5.5580 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -5.9310 -1.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -4.6330 -0.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -4.2170 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -4.2160 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -3.4270 1.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -7.0460 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -8.3150 -2.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -9.0260 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -9.6150 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -11.4080 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -12.3880 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -11.6700 2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -10.7190 2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -9.7450 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -6.4420 -4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -6.1580 -1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4630 -3.3240 4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -3.8410 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 -2.1800 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -1.6520 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -2.3030 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -6.3810 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 -5.7050 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -9.8380 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -8.4000 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -8.8370 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -10.2330 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -11.9490 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -10.7610 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -13.0060 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -13.0690 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -11.1050 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -12.4030 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -10.1600 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -11.2990 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -9.0860 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -9.1430 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -6.6660 -4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -6.8800 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -5.3570 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -6.8270 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -10.5150 0.1560 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1700 -11.1360 0.0890 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 53 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END