PUBCHEM-ZINC04678578 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.8040 1.9590 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 0.5140 -0.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -0.1240 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -1.4580 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -1.6290 -0.6510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.4590 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -0.2500 -2.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -1.3930 -3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.8980 -4.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -0.7080 -5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -0.2530 -6.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 0.0130 -7.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -0.1770 -6.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -0.6390 -5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 0.0830 -7.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 0.4330 -8.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.5080 -9.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.1500 -10.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 1.1440 -11.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 2.0830 -10.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 1.7290 -9.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 0.5210 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.1920 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 0.4160 4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 1.7290 4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 2.4410 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 1.8430 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 3.8450 3.6950 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0580 4.3720 4.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 4.4730 2.6900 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8380 2.3030 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 2.1830 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 2.4680 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -2.2440 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 0.6530 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.0260 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -1.9700 -3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -0.9140 -5.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -0.1050 -7.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 0.3690 -8.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -0.7910 -4.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -1.5190 -9.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -0.8820 -11.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 1.4220 -12.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 3.0940 -10.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 2.4620 -8.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -1.2160 3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.1340 5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 2.2000 5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 2.3980 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 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 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END