PUBCHEM-ZINC03719734 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 0.2450 1.1930 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.2220 -0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.7460 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 0.0180 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -0.5970 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -2.0000 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -2.7630 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -2.1490 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.8270 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -4.2490 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -4.7850 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -4.1360 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -4.6620 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -5.8470 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -6.5080 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -5.9840 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -2.6990 0.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0710 -3.1130 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -0.4840 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 0.2700 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 -3.7930 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -3.5860 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 -4.5540 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -5.7430 -2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 -5.9640 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -4.9930 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5730 -5.2510 0.9680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -7.4540 -1.3160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 1.4260 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 1.6250 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 1.6380 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.1030 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -3.8470 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -4.5540 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -4.6680 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -3.2120 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -4.1460 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -6.2570 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -7.4350 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -6.5210 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -0.7700 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9070 0.0980 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 1.1470 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 0.6270 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -2.6680 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 -4.3820 -4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 -6.4910 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2060 -1.7370 0.0450 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.4020 -1.5050 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0450 -2.2190 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 48 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 48 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END