PUBCHEM-ZINC05568359 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 0 0 0 0 0 0999 V2000 0.0020 1.4370 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.0560 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -0.6200 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.0960 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.4760 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 2.1460 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 3.6260 -0.0740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1000 4.2180 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 4.2530 -0.0620 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7200 -0.6210 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7600 0.0050 0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -1.8360 -0.0770 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2570 -2.0190 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -2.7030 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -2.1090 1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -4.2040 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -4.7280 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -6.5240 1.6630 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 1.9630 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -0.4980 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 2.0330 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -2.4970 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.6350 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -4.4870 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -4.2970 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -4.4450 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 22 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 23 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M END