PUBCHEM-ZINC03686307 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.2610 1.2700 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.1370 -0.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -0.5810 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 0.2150 0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -0.3780 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -1.7670 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -2.5870 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.9720 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -4.1070 0.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7630 -4.5010 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -4.7160 1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -5.2230 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -5.7850 3.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -5.8440 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -5.3350 3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -4.7700 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7640 -5.4050 4.2930 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -6.1040 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 -6.5850 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -6.1370 -2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 -3.6470 -3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -3.9790 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 1.4540 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 1.7740 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 1.6790 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 1.2980 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 0.2500 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -2.1810 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -2.5720 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -5.1850 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -6.1750 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -6.2810 5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -4.3780 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -6.5130 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -6.4520 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 -7.6820 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9710 -6.2940 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -6.2610 -3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2390 -6.6990 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -2.7440 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -3.4680 -4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -4.6820 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -3.0580 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -4.5830 -0.8490 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6440 -4.2270 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 -4.7060 -2.9930 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.3690 -4.5750 -3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 -4.5270 -2.2550 H 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 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 44 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 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 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 46 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 44 1 M CHG 1 46 1 M END