PUBCHEM-ZINC05195168 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 -1.4160 0.5660 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -0.3580 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -1.3370 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -0.1850 -2.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6970 -1.2030 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 0.5650 -2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.6610 -4.4170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1710 -0.2840 -4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 0.5200 -2.9700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4230 -0.1530 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 1.8610 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 1.7470 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.8710 -1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 1.8290 -5.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 2.6630 -5.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 0.3950 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 1.6120 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 0.4120 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -1.4740 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -1.9990 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -0.0290 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 1.5400 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 2.4050 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 2.5050 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 0.8220 -4.2560 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9800 0.2590 -4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 1.8270 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 2.5650 -0.1280 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7040 1.7750 -5.7640 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 28 -1 M CHG 1 29 -1 M END