PUBCHEM-ZINC06904539 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.2590 2.2280 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 0.7740 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.0640 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 1.8510 1.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6620 1.8790 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 2.7470 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 2.3330 1.1730 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 3.5980 2.1260 3.3750 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 6.1650 2.2280 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 4.3030 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 5.2900 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 5.3470 3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 3.9430 4.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1760 3.5800 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 3.0380 3.6840 N 0 5 0 0 0 0 0 0 0 0 0 0 5.7230 3.9910 5.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 3.6520 6.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 4.4110 6.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 4.4580 8.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3480 3.8810 8.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 3.8640 9.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 3.9330 10.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 5.3900 11.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 5.9400 10.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 5.8520 8.6450 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.8680 2.8370 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 2.2810 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 0.3860 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 0.7270 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.0280 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.0970 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 2.7310 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 3.7680 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6280 4.6560 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 4.2260 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 6.2800 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 4.9580 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2730 5.7160 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 6.0150 4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 4.4320 9.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 2.8240 8.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 3.5510 11.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 3.3330 10.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 5.9820 10.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 5.4410 12.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 6.9820 10.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 5.3560 10.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4720 0.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -0.1200 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 4.6820 6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 2.5790 0.3320 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