PUBCHEM-ZINC06494271 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0640 1.4320 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0660 -0.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0240 -0.4520 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -0.4530 1.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8760 -0.2270 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -2.0080 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -2.4750 2.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 0.0700 2.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 1.3100 2.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 2.2070 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 3.4200 3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 3.6770 4.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 2.6160 4.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 2.2770 6.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 1.0340 6.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 0.5540 5.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 1.6580 4.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2730 2.0830 3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.6540 -1.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -1.5980 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 1.8640 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.6290 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.9560 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -0.6400 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 4.2270 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 0.4590 7.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -2.5960 0.1000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 27 -1 M END