PUBCHEM-ZINC03912852 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.1580 1.4920 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -0.0320 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -0.4400 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -0.5180 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.6330 -1.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -0.3860 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 0.7320 -0.1190 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -1.0180 -2.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -1.8960 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -1.3030 -4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -0.8910 -4.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -0.6570 -5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -0.2910 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -0.3020 -4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -0.6750 -3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -0.8440 -2.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3700 0.0420 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -2.0620 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -3.2840 -2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 -4.4050 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -4.3040 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 -3.0740 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 -1.9530 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9710 -2.9700 1.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -1.6760 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6690 -5.4060 -0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4670 -6.6350 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 1.8480 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 1.7780 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 1.9370 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -0.0850 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -1.5260 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 0.0000 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -0.2270 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -1.6040 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -0.0700 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -1.2100 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -2.8840 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -1.9770 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -2.0530 -5.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -0.4360 -4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -0.7490 -6.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 -0.0360 -6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 -0.0560 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -3.3640 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 -5.3590 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -0.9960 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5090 -0.9790 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 -1.3280 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 -1.7330 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -6.8800 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -6.5310 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0220 -7.4310 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 16 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END