PUBCHEM-ZINC05649403 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 66 0 0 1 0 0 0 0 0999 V2000 -0.1660 1.2740 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -0.1820 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -0.7910 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -2.2740 1.3690 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2170 -2.8230 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -2.8870 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -4.2090 2.7510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5910 -4.9900 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -2.5510 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -5.0250 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -4.8550 2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -4.6650 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -4.6290 5.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -5.0750 4.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -5.5700 5.7580 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4690 -6.1430 6.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -6.5080 5.6650 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3710 -5.9760 5.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 -7.8010 4.8800 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9560 -7.5810 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -8.7060 4.8930 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3090 -8.2220 4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -8.9890 6.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7930 -9.6440 6.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 -7.6440 7.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9910 -7.1100 6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -6.8300 6.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 -7.9720 8.7880 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 -6.2660 9.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -9.7050 6.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -9.8070 7.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -9.9320 4.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -10.3600 4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -8.4990 5.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -8.9660 6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -4.3930 6.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7020 -4.8000 7.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -3.4730 6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -3.5720 6.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -4.0670 6.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 1.3710 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.6900 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.8760 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -0.2410 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -0.7490 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -0.6790 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -0.2290 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -3.0390 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -2.2450 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -1.8400 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -2.5940 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -5.9570 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -5.0330 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -5.6980 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -4.8230 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -3.9390 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -5.0240 3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -5.7260 9.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -6.2710 10.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 -5.7510 8.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -3.0140 5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -2.6480 7.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -4.0020 6.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -3.9000 2.6040 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5040 -3.8130 3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 64 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 9 64 1 0 0 0 0 10 11 1 0 0 0 0 10 52 1 0 0 0 0 10 53 1 0 0 0 0 10 64 1 0 0 0 0 11 54 1 0 0 0 0 11 55 1 0 0 0 0 11 56 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 38 61 1 0 0 0 0 38 62 1 0 0 0 0 38 63 1 0 0 0 0 39 40 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END