PUBCHEM-ZINC06904538 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.5050 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 1.4880 1.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6820 1.8200 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 1.9700 1.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 2.4340 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 2.4530 3.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 2.9300 2.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7200 3.4940 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 1.7360 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 2.2450 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 3.1840 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 4.3360 3.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3090 4.8940 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 3.7970 3.4690 N 0 5 0 0 0 0 0 0 0 0 0 0 7.3200 5.2530 4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 5.1720 5.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 6.1640 4.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4880 7.0550 5.8000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5920 7.0280 6.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7230 8.4840 5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9250 9.4090 6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1040 8.8980 7.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8290 7.4570 7.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6440 6.6130 6.5900 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8890 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.3820 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.3560 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.1640 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -1.5950 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 1.7290 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 3.1380 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 1.1630 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 1.1000 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 1.4000 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1410 2.7840 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 2.6350 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1580 3.5840 3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6110 8.5100 4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8580 8.8180 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 10.4200 6.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 9.4140 7.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0140 8.9300 6.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2260 9.5280 8.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6730 7.0860 8.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9270 7.4280 8.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 0.0210 1.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.3710 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9130 6.2290 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 1.9550 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 50 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 53 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 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 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 17 -1 M CHG 1 27 -1 M END