PUBCHEM-ZINC03601697 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 0.2030 1.4480 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.0450 0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4550 -0.5710 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.5050 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -1.3980 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -1.8090 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -1.3460 -3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -0.4560 -3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.0410 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -1.7780 -4.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -1.3490 -6.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -1.9390 -7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -2.8830 -7.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -0.4340 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -1.5990 0.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 1.6780 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 2.0660 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 1.7640 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -1.7840 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -2.5030 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -0.0670 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 0.6470 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -2.4460 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -1.6710 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -0.2570 -6.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -1.5470 -7.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -3.2600 -8.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -3.3020 -8.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 0.4510 -0.3090 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 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 M CHG 1 29 -1 M END