PUBCHEM-ZINC06073714 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 58 0 0 1 0 0 0 0 0999 V2000 0.7210 0.6250 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -0.3700 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -0.0770 0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -1.6110 -1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -2.7580 -0.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7490 -3.5440 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -2.5140 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -2.0680 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -2.9770 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -2.5580 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 -1.2230 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 -0.3270 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -0.7340 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -0.8210 -3.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 0.5630 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 1.4320 -4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 3.0860 -4.5100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -1.7630 -4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 -2.5280 -3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7710 -3.6760 -4.8160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -3.3240 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -3.9940 1.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -3.1460 0.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -3.6130 0.8160 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7240 -3.5290 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -5.0490 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -6.0910 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -7.7780 0.6270 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -8.7050 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -2.7280 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -2.0550 -0.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 0.1640 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.9840 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.4700 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -1.7430 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -3.4380 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -1.7910 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -4.0260 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 -3.3310 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 0.7290 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 0.0070 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7760 0.5550 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7660 0.9910 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 1.5010 -4.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9380 1.0310 -5.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 -1.2030 -5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -2.4400 -4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6300 -3.1010 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7750 -1.8450 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -2.5880 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -5.1270 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 -5.2740 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 -5.9710 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -5.9930 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -8.4750 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -9.7760 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -8.4650 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -2.7800 1.1620 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 2 0 0 0 0 30 58 1 0 0 0 0 M CHG 1 58 -1 M END