PUBCHEM-ZINC00169169 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.3860 0.7810 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.4470 -0.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -0.7670 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -1.9440 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -2.3860 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -1.6510 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -0.4810 2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -0.0370 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -2.1560 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -1.5330 5.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -0.1330 5.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 0.8550 5.0740 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3210 -2.1800 6.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -1.6820 7.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 -0.5980 7.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -2.6330 8.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -3.8030 8.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -4.7240 9.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 -4.4750 9.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 -3.3060 9.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7450 -2.3780 8.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 -0.9730 8.0580 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 0.7620 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 0.9060 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 1.6310 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -2.5190 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -3.2990 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 0.1040 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 0.8830 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -3.1440 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -3.0960 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -3.9930 8.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -5.6310 9.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -5.1920 10.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4600 -3.1280 9.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -0.1710 5.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 12 -1 M END