PUBCHEM-ZINC01567194 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7160 -0.4990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.7930 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -1.3510 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.5190 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -0.4840 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.0360 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.4630 -3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.0570 -4.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.4210 -6.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 0.2550 -6.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -0.5450 -7.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -1.6790 -7.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -1.6140 -6.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.6720 -6.3060 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2190 -2.5010 -5.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -3.7140 -6.9310 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8420 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8260 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8160 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -1.4100 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 0.2660 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -1.5400 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 0.1210 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -2.4100 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -1.1870 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 0.3120 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -1.1500 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -0.1200 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -1.5740 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -0.3270 -2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 1.1260 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -0.1000 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.5530 -3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -0.3060 -4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 1.1470 -4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 1.2420 -6.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.3140 -8.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 2 1 M CHG 1 16 1 M CHG 1 18 -1 M END