PUBCHEM-ZINC06035165 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.5820 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -2.1080 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -2.5320 -0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -2.8010 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -2.6980 1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -3.2220 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -3.5220 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -3.9110 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -4.0080 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -3.7200 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -3.3200 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -3.0270 -2.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -2.6580 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -2.3020 -1.4710 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -2.6210 -3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -2.3740 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -2.0160 -2.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -2.5490 -4.8140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -2.3090 -5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -2.5750 -6.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -3.7520 -7.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 -3.7560 -8.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -2.5830 -9.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 -1.3790 -7.8780 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.2470 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.2720 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.5500 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -2.4370 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 -3.4490 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4830 -4.1430 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -4.3160 -4.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -3.8000 -4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -1.9560 -3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -3.6570 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -2.8350 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -2.9730 -4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -1.2730 -4.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 -4.6350 -6.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5720 -4.6430 -9.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 -2.3990 -10.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 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 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 M END