PUBCHEM-ZINC05234233 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0780 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.7930 -2.5060 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.1740 -3.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.0110 -2.5180 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2490 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -5.0450 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -6.3710 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -6.3340 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -5.0420 -0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -7.4550 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -7.2800 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -8.4010 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -9.5260 -2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -8.2110 -3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -9.3180 -3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 -9.1350 -4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 -7.8540 -5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -6.7510 -4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -6.9230 -3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 -7.6800 -5.9700 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6190 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -4.7080 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -7.2540 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -8.4520 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -6.2830 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2710 -10.3160 -3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -9.9910 -5.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7650 -5.7550 -4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -6.0630 -3.2780 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END