PUBCHEM-ZINC05114520 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -0.7270 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 0.2500 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -0.4830 -0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7090 -1.0020 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 0.5290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -0.1550 -0.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 -0.2540 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8470 -0.9610 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 -1.2840 -0.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9290 -0.8090 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -0.9600 1.9840 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6860 -0.4700 2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4740 -1.5740 2.6760 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.9170 -1.4310 1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -0.6460 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -1.6640 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -0.1150 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 1.0330 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 0.6940 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 0.9840 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 1.3030 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 0.1560 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5470 -1.2220 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 -1.0390 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -0.0270 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -1.6380 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.7300 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.7030 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 33 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END