PUBCHEM-ZINC04823310 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2170 -0.6710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -0.0150 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3070 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 2.0540 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 3.3650 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 3.4680 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 2.2310 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 1.9360 -0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0540 1.0500 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 1.7340 1.4070 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4440 0.6720 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7860 2.3720 1.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5470 1.6250 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9470 2.8830 -0.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4680 2.1430 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 3.0670 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7060 4.2120 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 4.6090 -1.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8560 3.4560 2.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 2.4050 2.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -0.7660 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3320 -0.1760 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -1.9840 0.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9510 1.9200 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -1.7510 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 4.4000 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 4.9750 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6570 4.0930 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4240 5.4450 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7190 3.8930 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 2.3110 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END