PUBCHEM-ZINC04087046 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 0 0 0 0 0999 V2000 0.4340 1.2320 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -0.2780 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -1.0020 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -0.6160 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -0.7200 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 0.2100 -2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -0.1950 -3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -1.5310 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -2.4660 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -2.0640 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -3.0080 -0.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -3.9220 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -4.0840 -4.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -4.7290 -2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -4.4300 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 0.8050 -4.1140 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6860 1.9820 -3.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 0.4500 -5.1620 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4970 1.4730 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 1.7480 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 1.5520 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.6120 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -2.0700 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -0.8400 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.1790 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -1.6990 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -0.2130 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 1.2540 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -1.8430 -4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -2.7180 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -3.9530 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -3.7220 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -5.1370 -4.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -3.5090 -5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -4.6860 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -5.7660 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -4.3100 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -3.9490 -4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -5.5100 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -4.1930 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 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 16 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END