PUBCHEM-ZINC06157879 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.4030 1.3120 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1150 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.4630 1.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -1.7600 1.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -2.0960 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -3.6800 2.3950 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -1.1850 3.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -1.5040 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -2.7270 4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -3.0390 6.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -2.1340 6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -0.9140 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -0.5940 4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -1.1330 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -1.2680 -2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -2.2860 -3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -3.6180 -2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -4.5520 -3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -4.1530 -5.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.8200 -5.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -1.8860 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 1.4300 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 1.5620 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 1.9770 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -2.4150 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -0.3090 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -3.4350 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -3.9900 6.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -2.3800 7.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -0.2100 6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 0.3600 4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -0.8100 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -2.0970 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -1.5910 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -0.3040 -2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -3.9290 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -5.5930 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -4.8820 -5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.5090 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.8450 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 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 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 M END