PUBCHEM-ZINC04981372 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 0 0 0 0 0 0999 V2000 0.5060 -1.9210 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -2.0880 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.7020 2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -0.3890 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -0.4060 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 1.1020 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 0.9030 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 2.9920 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4170 3.3950 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 3.2230 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8820 3.5620 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9410 4.0840 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 4.2560 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 3.9230 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1690 4.4130 -1.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4090 4.2670 -2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2650 4.9240 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -1.5840 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -2.8780 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -1.1980 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -2.4520 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.7870 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 0.0870 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -1.6650 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 0.5700 1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -1.1590 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -0.3220 3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -0.7160 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -1.0150 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 1.6700 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 1.4370 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -0.1840 2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 1.3180 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 1.1570 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 3.4160 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 3.3610 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 2.8320 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9970 3.4060 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4400 4.6610 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 4.0850 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 4.8800 -3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4170 4.5910 -2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 3.2200 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5400 4.2030 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1680 5.1070 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9920 5.8770 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.7400 1.2300 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2480 -0.0360 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 1.4770 1.2740 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2500 1.1020 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 47 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 47 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 6 49 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 49 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 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 47 1 M CHG 1 49 1 M END