PUBCHEM-ZINC04202961 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 -0.9560 1.2690 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -0.0140 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.7660 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -1.9370 1.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -2.3870 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -1.7240 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.4990 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 0.2310 -2.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2200 1.3090 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 0.1030 -3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -0.2800 -4.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 2.1200 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 1.2620 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 1.4190 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -0.4340 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -3.3290 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -2.1590 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 0.4150 -2.7960 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8580 -0.2470 -3.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -1.2680 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -0.0840 -4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 18 -1 M END