PUBCHEM-ZINC05828856 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 2.3600 -0.8880 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.0880 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -0.5970 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0380 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -0.6050 3.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -1.7080 4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -1.9920 4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -1.0900 4.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 -1.0590 4.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -0.2330 3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 0.7610 3.0010 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2350 1.2380 3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 2.4060 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 2.1540 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 1.5940 1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -3.0460 5.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -3.7860 6.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -4.7120 6.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -3.5210 5.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -4.0700 5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -2.5000 4.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -2.2640 3.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -3.3610 6.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -1.9690 -0.8750 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -1.6600 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -0.9530 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 0.0940 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -0.6480 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.0880 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 1.1000 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 0.4330 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 1.5850 4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 2.3620 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 3.3630 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 1.4210 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 3.0850 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 2.4060 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 0.9860 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -4.0720 5.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -3.7970 7.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -2.4480 6.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 11 1 M END