PUBCHEM-ZINC06547197 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 4.3010 -8.3890 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -7.3620 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -8.0280 0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -7.2620 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -6.0750 0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -7.8830 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -6.8460 0.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -7.1710 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -8.3220 0.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -6.1040 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6070 -5.6010 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -5.1010 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -3.8730 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -3.1280 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -3.7520 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 -5.3670 2.7330 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -6.7180 -0.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 -6.4730 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -7.2630 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6020 -7.0190 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5260 -5.9890 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 -5.2010 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9010 -5.4430 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0670 -4.5870 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6790 -4.0790 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 -7.5190 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 -7.6730 1.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9290 -8.2040 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -9.0590 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7720 -9.5160 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1210 -9.0920 -0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0410 -8.1240 -0.6520 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.6270 -10.4390 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2760 -10.8190 2.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7960 -10.8630 1.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 -9.4130 2.8610 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -7.8890 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -8.8610 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -9.1480 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -6.6030 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -6.8900 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -8.6370 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -8.3500 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -5.9250 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -3.4880 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -2.1190 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -3.3280 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 -8.0670 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -7.6320 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1330 -5.8000 -4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -3.6850 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1150 -4.3130 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -5.1450 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6370 -4.4540 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3300 -3.2820 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7970 -3.6900 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0760 -10.5600 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3590 -11.4700 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1840 -9.0560 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5310 -10.0170 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 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 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 36 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 M END