PUBCHEM-ZINC04520906 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 2.2420 1.3990 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 0.0180 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6810 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 0.0000 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 1.3810 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4830 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 4.0150 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 5.4690 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 5.3310 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 4.0280 0.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2330 3.3140 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 4.3240 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 5.3640 2.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.1610 -0.0190 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1580 -2.7620 0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -2.7770 -0.5250 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0580 1.9440 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -0.5170 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -0.5480 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.9130 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 3.4450 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 4.0050 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 5.8370 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 6.1220 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 5.2580 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 6.1790 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 3.4240 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 4.6400 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 5.6050 2.9360 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 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END